2-[[3-[(E)-3-(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)-3-oxidanylidene-prop-1-enyl]phenyl]carbonylamino]butanedioic acid

Systemtic Name: 2-[[3-[(E)-3-(6-methyl-2-oxidanyl-4-oxidanylidene-1H-pyridin-3-yl)-3-oxidanylidene-prop-1-enyl]phenyl]carbonylamino]butanedioic acid Openeye Name: 2-[[3-[(E)-3-(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)-3-oxo-prop-1-enyl]benzoyl]amino]butanedioic acid CAS Name: 2-[[[3-[(E)-3-(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)-3-oxoprop-1-enyl]phenyl]-oxomethyl]amino]butanedioic acid IUPAC Name: 2-[[3-[(E)-3-(2-hydroxy-6-methyl-4-oxo-1H-pyridin-3-yl)-3-oxoprop-1-enyl]benzoyl]amino]butanedioic acid Traditional Name: 2-[[3-[(E)-3-(2-hydroxy-4-keto-6-methyl-1H-pyridin-3-yl)-3-keto-prop-1-enyl]benzoyl]amino]succinic acid Formula: C20H18N2O8 MolecularWeight: 414.36552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1)O)C(=O)C=CC2=CC(=CC=C2)C(=O)NC(CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=O)C(=C(N1)O)C(=O)/C=C/C2=CC(=CC=C2)C(=O)NC(CC(=O)O)C(=O)O

InChI

InChI=1S/C20H18N2O8/c1-10-7-15(24)17(19(28)21-10)14(23)6-5-11-3-2-4-12(8-11)18(27)22-13(20(29)30)9-16(25)26/h2-8,13H,9H2,1H3,(H,22,27)(H,25,26)(H,29,30)(H2,21,24,28)/b6-5+