3-(3,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-(3-hydroxyphenyl)-5-[(4-methoxyphenyl)methyl]-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 3-(3,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-(3-hydroxyphenyl)-5-[(4-methoxyphenyl)methyl]-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one Openeye Name: 3-(3,5-dimethyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-4-(3-hydroxyphenyl)-5-[(4-methoxyphenyl)methyl]-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one CAS Name: 3-(3,5-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)-4-(3-hydroxyphenyl)-5-[(4-methoxyphenyl)methyl]-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 3-(3,5-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)-4-(3-hydroxyphenyl)-5-[(4-methoxyphenyl)methyl]-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one Traditional Name: 4-(3-hydroxyphenyl)-3-(6-keto-3,5-dimethyl-cyclohexa-2,4-dien-1-ylidene)-5-p-anisyl-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C3=C(C(=O)N(C3C4=CC(=CC=C4)O)CC5=CC=C(C=C5)OC)NN2)C(=O)C(=C1)C

Isomeric SMILES

CC1=CC(=C2C3=C(C(=O)N(C3C4=CC(=CC=C4)O)CC5=CC=C(C=C5)OC)NN2)C(=O)C(=C1)C

InChI

InChI=1S/C27H25N3O4/c1-15-11-16(2)26(32)21(12-15)23-22-24(29-28-23)27(33)30(14-17-7-9-20(34-3)10-8-17)25(22)18-5-4-6-19(31)13-18/h4-13,25,28-29,31H,14H2,1-3H3