2-[(2Z)-2-[4-methyl-2,6-bis(oxidanylidene)-1-phenyl-5-propanoyl-pyridin-3-ylidene]hydrazinyl]-5-sulfo-benzoic acid

Systemtic Name: 2-[(2Z)-2-[4-methyl-2,6-bis(oxidanylidene)-1-phenyl-5-propanoyl-pyridin-3-ylidene]hydrazinyl]-5-sulfo-benzoic acid Openeye Name: 2-[(2Z)-2-(4-methyl-2,6-dioxo-1-phenyl-5-propanoyl-3-pyridylidene)hydrazino]-5-sulfo-benzoic acid CAS Name: 2-[(2Z)-2-[4-methyl-2,6-dioxo-5-(1-oxopropyl)-1-phenyl-3-pyridinylidene]hydrazinyl]-5-sulfobenzoic acid IUPAC Name: 2-[(2Z)-2-(4-methyl-2,6-dioxo-1-phenyl-5-propanoylpyridin-3-ylidene)hydrazinyl]-5-sulfobenzoic acid Traditional Name: 2-[(N'Z)-N'-(2,6-diketo-4-methyl-1-phenyl-5-propionyl-3-pyridylidene)hydrazino]-5-sulfo-benzoic acid Formula: C22H19N3O8S MolecularWeight: 485.46656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=NNC2=C(C=C(C=C2)S(=O)(=O)O)C(=O)O)C(=O)N(C1=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC(=O)C1=C(/C(=N/NC2=C(C=C(C=C2)S(=O)(=O)O)C(=O)O)/C(=O)N(C1=O)C3=CC=CC=C3)C

InChI

InChI=1S/C22H19N3O8S/c1-3-17(26)18-12(2)19(21(28)25(20(18)27)13-7-5-4-6-8-13)24-23-16-10-9-14(34(31,32)33)11-15(16)22(29)30/h4-11,23H,3H2,1-2H3,(H,29,30)(H,31,32,33)/b24-19-