4-[(3E)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-2-yl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-[(3E)-3-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-2-yl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-[(3E)-3-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-2-yl]benzamide CAS Name: 4-[(3E)-3-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrazol-2-yl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-[(3E)-3-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazol-2-yl]benzamide Traditional Name: N-benzyl-4-[(5E)-5-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-3-pyrazolin-1-yl]benzamide Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3C(=C4C=CC(=O)C=C4O)C=CN3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)N3/C(=C/4\C=CC(=O)C=C4O)/C=CN3

InChI

InChI=1S/C23H19N3O3/c27-19-10-11-20(22(28)14-19)21-12-13-25-26(21)18-8-6-17(7-9-18)23(29)24-15-16-4-2-1-3-5-16/h1-14,25,28H,15H2,(H,24,29)/b21-20+