4-[2-(2,3-dimethylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(2,3-dimethylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(2,3-dimethylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(2,3-dimethylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(2,3-dimethylphenyl)-3,4-bis(4-hydroxyphenyl)-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(2,3-dimethylphenyl)-4,5-bis(4-hydroxyphenyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C29H24N2O3 MolecularWeight: 448.51246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=C(C(=C3C=CC(=O)C=C3)N2)C4=CC=C(C=C4)O)C5=CC=C(C=C5)O)C

InChI

InChI=1S/C29H24N2O3/c1-18-4-3-5-26(19(18)2)31-29(22-10-16-25(34)17-11-22)27(20-6-12-23(32)13-7-20)28(30-31)21-8-14-24(33)15-9-21/h3-17,30,32,34H,1-2H3