4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride

Systemtic Name: 4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Openeye Name: 4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride CAS Name: 4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone hydrochloride IUPAC Name: 4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Traditional Name: 4-[2-(dimethylamino)-4-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Formula: C18H18ClN3O MolecularWeight: 327.80802

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=CC(=C2C=CC(=O)C=C2)N1)C3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)C1=NC(=CC(=C2C=CC(=O)C=C2)N1)C3=CC=CC=C3.Cl

InChI

InChI=1S/C18H17N3O.ClH/c1-21(2)18-19-16(13-6-4-3-5-7-13)12-17(20-18)14-8-10-15(22)11-9-14;/h3-12H,1-2H3,(H,19,20);1H