6-[(5R)-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)carbonyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-1-(4-methylphenyl)carbonyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-1-(4-methylbenzoyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-1-[(4-methylphenyl)-oxomethyl]-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-1-(4-methylbenzoyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-1-p-toluoyl-pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC(=C3C=CC=CC3=O)N2)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2[C@H](CC(=C3C=CC=CC3=O)N2)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H24N2O4/c1-16-8-10-17(11-9-16)25(29)27-21(18-12-13-23(30-2)24(14-18)31-3)15-20(26-27)19-6-4-5-7-22(19)28/h4-14,21,26H,15H2,1-3H3/t21-/m1/s1