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4-[[1-(4-carboxyphenyl)-2-keto-5-phenyl-3-pyrrolin-3-yl]amino]benzoic acid

View entire compound with spectra: 1 MS (GC)

4-[[1-(4-carboxyphenyl)-2-keto-5-phenyl-3-pyrrolin-3-yl]amino]benzoic acid
SpectraBase Compound ID 9FMkKZRhIas
InChI InChI=1S/C24H18N2O5/c27-22-20(25-18-10-6-16(7-11-18)23(28)29)14-21(15-4-2-1-3-5-15)26(22)19-12-8-17(9-13-19)24(30)31/h1-14,21,25H,(H,28,29)(H,30,31)
InChIKey ILPBPCQXVRDLNO-UHFFFAOYSA-N
Mol Weight 414.42 g/mol
Molecular Formula C24H18N2O5
Exact Mass 414.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ks7lPFsGY7
Name 4-[[1-(4-carboxyphenyl)-2-keto-5-phenyl-3-pyrrolin-3-yl]amino]benzoic acid
Alternate Name(s) 4-[[1-(4-carboxyphenyl)-5-oxidanylidene-2-phenyl-2H-pyrrol-4-yl]amino]benzoic acid 4-[[1-(4-carboxyphenyl)-5-oxo-2-phenyl-2H-pyrrol-4-yl]amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H18N2O5
InChI InChI=1S/C24H18N2O5/c27-22-20(25-18-10-6-16(7-11-18)23(28)29)14-21(15-4-2-1-3-5-15)26(22)19-12-8-17(9-13-19)24(30)31/h1-14,21,25H,(H,28,29)(H,30,31)
InChIKey ILPBPCQXVRDLNO-UHFFFAOYSA-N
Molecular Weight 414.417 g/mol
SMILES OC(c1ccc(N2C(C(=CC2c2ccccc2)Nc2ccc(C(=O)O)cc2)=O)cc1)=O
SPLASH splash10-0udi-2390000000-0e62a91fb280186293cc
Wiley ID 1443143