3-[1-(cyclohexylmethyl)piperidin-4-yl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride

Systemtic Name: 3-[1-(cyclohexylmethyl)piperidin-4-yl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride Openeye Name: 3-[1-(cyclohexylmethyl)-4-piperidyl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride CAS Name: 3-[1-(cyclohexylmethyl)-4-piperidinyl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride IUPAC Name: 3-[1-(cyclohexylmethyl)piperidin-4-yl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride Traditional Name: 3-[1-(cyclohexylmethyl)-4-piperidyl]-1-methyl-4-phenyl-4H-quinazolin-2-one hydrochloride Formula: C27H36ClN3O MolecularWeight: 454.04724

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(N(C1=O)C3CCN(CC3)CC4CCCCC4)C5=CC=CC=C5.Cl

Isomeric SMILES

CN1C2=CC=CC=C2C(N(C1=O)C3CCN(CC3)CC4CCCCC4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C27H35N3O.ClH/c1-28-25-15-9-8-14-24(25)26(22-12-6-3-7-13-22)30(27(28)31)23-16-18-29(19-17-23)20-21-10-4-2-5-11-21;/h3,6-9,12-15,21,23,26H,2,4-5,10-11,16-20H2,1H3;1H