3-[(2-chlorophenyl)amino]-5,5-dimethyl-2-(piperidin-1-ylmethyl)cyclohex-2-en-1-one hydrochloride

Systemtic Name: 3-[(2-chlorophenyl)amino]-5,5-dimethyl-2-(piperidin-1-ylmethyl)cyclohex-2-en-1-one hydrochloride Openeye Name: 3-(2-chloroanilino)-5,5-dimethyl-2-(1-piperidylmethyl)cyclohex-2-en-1-one hydrochloride CAS Name: 3-(2-chloroanilino)-5,5-dimethyl-2-(1-piperidinylmethyl)-1-cyclohex-2-enone hydrochloride IUPAC Name: 3-(2-chloroanilino)-5,5-dimethyl-2-(piperidin-1-ylmethyl)cyclohex-2-en-1-one hydrochloride Traditional Name: 3-(2-chloroanilino)-5,5-dimethyl-2-(piperidinomethyl)cyclohex-2-en-1-one hydrochloride Formula: C20H28Cl2N2O MolecularWeight: 383.35512

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)CN2CCCCC2)NC3=CC=CC=C3Cl)C.Cl

Isomeric SMILES

CC1(CC(=C(C(=O)C1)CN2CCCCC2)NC3=CC=CC=C3Cl)C.Cl

InChI

InChI=1S/C20H27ClN2O.ClH/c1-20(2)12-18(22-17-9-5-4-8-16(17)21)15(19(24)13-20)14-23-10-6-3-7-11-23;/h4-5,8-9,22H,3,6-7,10-14H2,1-2H3;1H