4-[[methyl-[3-[(Z)-6-oxidanyl-6-oxidanylidene-1-pyridin-3-yl-hex-1-enyl]phenyl]carbamoyl]amino]benzoic acid

Systemtic Name: 4-[[methyl-[3-[(Z)-6-oxidanyl-6-oxidanylidene-1-pyridin-3-yl-hex-1-enyl]phenyl]carbamoyl]amino]benzoic acid Openeye Name: 4-[[[3-[(Z)-6-hydroxy-6-oxo-1-(3-pyridyl)hex-1-enyl]phenyl]-methyl-carbamoyl]amino]benzoic acid CAS Name: 4-[[[3-[(Z)-6-hydroxy-6-oxo-1-(3-pyridinyl)hex-1-enyl]-N-methylanilino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[[3-[(Z)-6-hydroxy-6-oxo-1-pyridin-3-ylhex-1-enyl]phenyl]-methylcarbamoyl]amino]benzoic acid Traditional Name: 4-[[[3-[(Z)-6-hydroxy-6-keto-1-(3-pyridyl)hex-1-enyl]phenyl]-methyl-carbamoyl]amino]benzoic acid Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC(=C1)C(=CCCCC(=O)O)C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(C1=CC=CC(=C1)/C(=C/CCCC(=O)O)/C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C26H25N3O5/c1-29(26(34)28-21-13-11-18(12-14-21)25(32)33)22-8-4-6-19(16-22)23(9-2-3-10-24(30)31)20-7-5-15-27-17-20/h4-9,11-17H,2-3,10H2,1H3,(H,28,34)(H,30,31)(H,32,33)/b23-9-