4-[2-methyl-4-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride

Systemtic Name: 4-[2-methyl-4-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Openeye Name: 4-[2-methyl-4-[2-(4-phenyl-1-piperidyl)ethoxy]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride CAS Name: 4-[2-methyl-4-[2-(4-phenyl-1-piperidinyl)ethoxy]-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone hydrochloride IUPAC Name: 4-[2-methyl-4-[2-(4-phenylpiperidin-1-yl)ethoxy]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Traditional Name: 4-[2-methyl-4-[2-(4-phenylpiperidino)ethoxy]-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one hydrochloride Formula: C24H28ClN3O2 MolecularWeight: 425.95102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C2C=CC(=O)C=C2)N1)OCCN3CCC(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=NC(=CC(=C2C=CC(=O)C=C2)N1)OCCN3CCC(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H27N3O2.ClH/c1-18-25-23(21-7-9-22(28)10-8-21)17-24(26-18)29-16-15-27-13-11-20(12-14-27)19-5-3-2-4-6-19;/h2-10,17,20H,11-16H2,1H3,(H,25,26);1H