4-[4-(3,4-dimethoxyphenyl)-2-piperidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(3,4-dimethoxyphenyl)-2-piperidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(3,4-dimethoxyphenyl)-2-(1-piperidyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(3,4-dimethoxyphenyl)-2-(1-piperidinyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)-2-piperidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(3,4-dimethoxyphenyl)-2-piperidino-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=N2)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=N2)N4CCCCC4)OC

InChI

InChI=1S/C23H25N3O3/c1-28-21-11-8-17(14-22(21)29-2)20-15-19(16-6-9-18(27)10-7-16)24-23(25-20)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13H2,1-2H3,(H,24,25)