3-(3,5-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-4-(3-methoxy-4-oxidanyl-phenyl)-5-(3-oxidanylpropyl)-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-methoxy-4-oxidanyl-phenyl)-5-(3-oxidanylpropyl)-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-(4-hydroxy-3-methoxy-phenyl)-5-(3-hydroxypropyl)-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-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-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-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one Traditional Name: 4-(4-hydroxy-3-methoxy-phenyl)-5-(3-hydroxypropyl)-3-(6-keto-3,5-dimethyl-cyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O5/c1-12-9-13(2)22(29)15(10-12)19-18-20(25-24-19)23(30)26(7-4-8-27)21(18)14-5-6-16(28)17(11-14)31-3/h5-6,9-11,21,24-25,27-28H,4,7-8H2,1-3H3