2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5,5-dimethyl-3-phenylazanyl-cyclohex-2-en-1-one hydrochloride

Systemtic Name: 2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5,5-dimethyl-3-phenylazanyl-cyclohex-2-en-1-one hydrochloride Openeye Name: 3-anilino-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5,5-dimethyl-cyclohex-2-en-1-one hydrochloride CAS Name: 3-anilino-2-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-5,5-dimethyl-1-cyclohex-2-enone hydrochloride IUPAC Name: 3-anilino-2-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-5,5-dimethylcyclohex-2-en-1-one hydrochloride Traditional Name: 3-anilino-2-[[4-(2-hydroxyethyl)piperazino]methyl]-5,5-dimethyl-cyclohex-2-en-1-one hydrochloride Formula: C21H32ClN3O2 MolecularWeight: 393.95068

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)CN2CCN(CC2)CCO)NC3=CC=CC=C3)C.Cl

Isomeric SMILES

CC1(CC(=C(C(=O)C1)CN2CCN(CC2)CCO)NC3=CC=CC=C3)C.Cl

InChI

InChI=1S/C21H31N3O2.ClH/c1-21(2)14-19(22-17-6-4-3-5-7-17)18(20(26)15-21)16-24-10-8-23(9-11-24)12-13-25;/h3-7,22,25H,8-16H2,1-2H3;1H