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3-[3-(4-benzylpiperazino)propanoylamino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester
SpectraBase Compound ID 5StHsWaV7xk
InChI InChI=1S/C24H27FN4O3/c1-32-24(31)23-22(19-15-18(25)7-8-20(19)26-23)27-21(30)9-10-28-11-13-29(14-12-28)16-17-5-3-2-4-6-17/h2-8,15,26H,9-14,16H2,1H3,(H,27,30)
InChIKey FMGNENURFWVUCY-UHFFFAOYSA-N
Mol Weight 438.5 g/mol
Molecular Formula C24H27FN4O3
Exact Mass 438.206719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Q2lHg7YpZs
Name 3-[3-(4-benzylpiperazino)propanoylamino]-5-fluoro-1H-indole-2-carboxylic acid methyl ester
Alternate Name(s) 5-Fluoro-3-[[1-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]amino]-1H-indole-2-carboxylic acid methyl ester Methyl 3-[3-(4-benzylpiperazin-1-yl)propanoylamino]-5-fluoro-1H-indole-2-carboxylate Methyl 5-fluoranyl-3-[3-[4-(phenylmethyl)piperazin-1-yl]propanoylamino]-1H-indole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27FN4O3
InChI InChI=1S/C24H27FN4O3/c1-32-24(31)23-22(19-15-18(25)7-8-20(19)26-23)27-21(30)9-10-28-11-13-29(14-12-28)16-17-5-3-2-4-6-17/h2-8,15,26H,9-14,16H2,1H3,(H,27,30)
InChIKey FMGNENURFWVUCY-UHFFFAOYSA-N
Molecular Weight 438.503 g/mol
SMILES [nH]1c2ccc(cc2c(c1C(=O)OC)NC(CCN1CCN(CC1)Cc1ccccc1)=O)F
SPLASH splash10-0006-9510000000-a01e9d7ffaea7b28f409
Wiley ID 1445485