1,3-dimethyl-3-phenyl-4-piperazin-1-yl-4-(2-propan-2-yloxyphenyl)piperidin-2-one hydrochloride

Systemtic Name: 1,3-dimethyl-3-phenyl-4-piperazin-1-yl-4-(2-propan-2-yloxyphenyl)piperidin-2-one hydrochloride Openeye Name: 4-(2-isopropoxyphenyl)-1,3-dimethyl-3-phenyl-4-piperazin-1-yl-piperidin-2-one hydrochloride CAS Name: 1,3-dimethyl-3-phenyl-4-(1-piperazinyl)-4-(2-propan-2-yloxyphenyl)-2-piperidinone hydrochloride IUPAC Name: 1,3-dimethyl-3-phenyl-4-piperazin-1-yl-4-(2-propan-2-yloxyphenyl)piperidin-2-one hydrochloride Traditional Name: 4-(2-isopropoxyphenyl)-1,3-dimethyl-3-phenyl-4-piperazino-2-piperidone hydrochloride Formula: C26H36ClN3O2 MolecularWeight: 458.03594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C2(CCN(C(=O)C2(C)C3=CC=CC=C3)C)N4CCNCC4.Cl

Isomeric SMILES

CC(C)OC1=CC=CC=C1C2(CCN(C(=O)C2(C)C3=CC=CC=C3)C)N4CCNCC4.Cl

InChI

InChI=1S/C26H35N3O2.ClH/c1-20(2)31-23-13-9-8-12-22(23)26(29-18-15-27-16-19-29)14-17-28(4)24(30)25(26,3)21-10-6-5-7-11-21;/h5-13,20,27H,14-19H2,1-4H3;1H