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n-(phenylsulfonyl)-5-amino-1-benzoyl-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl esterN,1-dibenzoyl-N-(phenylsulfonyl)-5-amino-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

n-(phenylsulfonyl)-5-amino-1-benzoyl-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl esterN,1-dibenzoyl-N-(phenylsulfonyl)-5-amino-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl ester
SpectraBase Compound ID KP5GyojXvgo
InChI InChI=1S/C31H26N2O6S/c1-21-29(31(35)38-2)25-18-26(32-40(36,37)24-16-10-5-11-17-24)28(39-20-22-12-6-3-7-13-22)19-27(25)33(21)30(34)23-14-8-4-9-15-23/h3-19,32H,20H2,1-2H3
InChIKey VMYQAEGYCHXEJM-UHFFFAOYSA-N
Mol Weight 554.62 g/mol
Molecular Formula C31H26N2O6S
Exact Mass 554.151158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9pfscqx3Yz
Name n-(phenylsulfonyl)-5-amino-1-benzoyl-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl esterN,1-dibenzoyl-N-(phenylsulfonyl)-5-amino-6-(benzyloxy)-2-methylindole-3-carboxylic acid methyl ester
Alternate Name(s) Methyl 1-benzoyl-6-(benzyloxy)-2-methyl-5-[(phenylsulfonyl)amino]-1H-indole-3-carboxylate
CAS Registry Number 124400-57-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H26N2O6S
InChI InChI=1S/C31H26N2O6S/c1-21-29(31(35)38-2)25-18-26(32-40(36,37)24-16-10-5-11-17-24)28(39-20-22-12-6-3-7-13-22)19-27(25)33(21)30(34)23-14-8-4-9-15-23/h3-19,32H,20H2,1-2H3
InChIKey VMYQAEGYCHXEJM-UHFFFAOYSA-N
Molecular Weight 554.617 g/mol
SMILES N(S(=O)(=O)c1ccccc1)c1c(cc2[n](c(c(C(=O)OC)c2c1)C)C(=O)c1ccccc1)OCc1ccccc1
SPLASH splash10-0a4i-4900020000-16bb3a5e20a32d129036
Source of Spectrum J-55-1387-20
Wiley ID 1406203