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5-Hydroxy-2-methyl-1-[3-(4-nitroanilino)propyl]-3-indolecarboxylic acid ethyl ester
SpectraBase Compound ID BRjXDU6MADg
InChI InChI=1S/C21H23N3O5/c1-3-29-21(26)20-14(2)23(19-10-9-17(25)13-18(19)20)12-4-11-22-15-5-7-16(8-6-15)24(27)28/h5-10,13,22,25H,3-4,11-12H2,1-2H3
InChIKey KGVFKECPKJCCTI-UHFFFAOYSA-N
Mol Weight 397.43 g/mol
Molecular Formula C21H23N3O5
Exact Mass 397.163771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31v3j8jTQ6Z
Name 5-Hydroxy-2-methyl-1-[3-(4-nitroanilino)propyl]-3-indolecarboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O5
InChI InChI=1S/C21H23N3O5/c1-3-29-21(26)20-14(2)23(19-10-9-17(25)13-18(19)20)12-4-11-22-15-5-7-16(8-6-15)24(27)28/h5-10,13,22,25H,3-4,11-12H2,1-2H3
InChIKey KGVFKECPKJCCTI-UHFFFAOYSA-N
Molecular Weight 397.431 g/mol
SMILES N(c1ccc(N(=O)=O)cc1)CCC[n]1c(c(c2cc(ccc12)O)C(=O)OCC)C
SPLASH splash10-03e9-2931000000-b09ee6fdae4fc1f6d084
Synonyms 5-Hydroxy-2-methyl-1-[3-(4-nitroanilino)propyl]indole-3-carboxylic acid ethyl ester Ethyl 2-methyl-1-[3-[(4-nitrophenyl)amino]propyl]-5-oxidanyl-indole-3-carboxylate Ethyl 5-hydroxy-2-methyl-1-[3-(4-nitroanilino)propyl]indole-3-carboxylate
Wiley ID 1461033