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3-[(5-(hydroxymethyl)-3-{[4-(methoxycarbonyl)anilino]carbonyl}-8-methyl-2H-pyrano[2,3-c]pyridin-2-ylidene)amino]benzoic acid
SpectraBase Compound ID 7Ozy6B7GDI1
InChI InChI=1S/C26H21N3O7/c1-14-22-20(17(13-30)12-27-14)11-21(23(31)28-18-8-6-15(7-9-18)26(34)35-2)24(36-22)29-19-5-3-4-16(10-19)25(32)33/h3-12,30H,13H2,1-2H3,(H,28,31)(H,32,33)/b29-24-
InChIKey QWSXTUFESFZYQW-OLFWJLLRSA-N
Mol Weight 487.47 g/mol
Molecular Formula C26H21N3O7
Exact Mass 487.13795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGCnxvZHmEG
Name 3-[(5-(hydroxymethyl)-3-{[4-(methoxycarbonyl)anilino]carbonyl}-8-methyl-2H-pyrano[2,3-c]pyridin-2-ylidene)amino]benzoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21N3O7
InChI InChI=1S/C26H21N3O7/c1-14-22-20(17(13-30)12-27-14)11-21(23(31)28-18-8-6-15(7-9-18)26(34)35-2)24(36-22)29-19-5-3-4-16(10-19)25(32)33/h3-12,30H,13H2,1-2H3,(H,28,31)(H,32,33)/b29-24-
InChIKey QWSXTUFESFZYQW-OLFWJLLRSA-N
Molecular Weight 487.468 g/mol
SMILES OCc1c2c(O\C(C(C(Nc3ccc(C(=O)OC)cc3)=O)=C2)=N\c2cc(C(=O)O)ccc2)c(nc1)C
SPLASH splash10-00ko-2293400000-ae50a1230e94c0d8f893
Synonyms 3-[((2Z)-5-(hydroxymethyl)-3-{[4-(methoxycarbonyl)anilino]carbonyl}-8-methyl-2H-pyrano[2,3-c]pyridin-2-ylidene)amino]benzoic acid Benzoic acid, 3-[[5-(hydroxymethyl)-3-[[[4-(methoxycarbonyl)phenyl]amino]carbonyl]-8-methyl-2H-pyrano[2,3-c]pyridin-2-yliden]amino]-
Wiley ID 1444902