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

Systemtic Name: 4-[4-(3,4-dimethoxyphenyl)-2-pyrrolidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(3,4-dimethoxyphenyl)-2-pyrrolidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(3,4-dimethoxyphenyl)-2-(1-pyrrolidinyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)-2-pyrrolidin-1-yl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(3,4-dimethoxyphenyl)-2-pyrrolidino-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H23N3O3 MolecularWeight: 377.43632

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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)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=N2)N4CCCC4)OC

InChI

InChI=1S/C22H23N3O3/c1-27-20-10-7-16(13-21(20)28-2)19-14-18(15-5-8-17(26)9-6-15)23-22(24-19)25-11-3-4-12-25/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,23,24)