4-[[2,6-bis(oxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-[[2,6-bis(oxidanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-[(2,6-dihydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-[(2,6-dihydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-[(2,6-dihydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 4-[(2,6-dihydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-5-methyl-2-phenyl-3-pyrazolin-3-one Formula: C17H14N2O4 MolecularWeight: 310.30406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=CC(=O)C=C3O)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=CC(=O)C=C3O)O

InChI

InChI=1S/C17H14N2O4/c1-10-13(9-14-15(21)7-12(20)8-16(14)22)17(23)19(18-10)11-5-3-2-4-6-11/h2-9,18,21-22H,1H3