1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]-2-(3-phenoxyphenyl)ethanone hydrochloride

Systemtic Name: 1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]-2-(3-phenoxyphenyl)ethanone hydrochloride Openeye Name: 1-[4-(1-cyclopropyl-1-methyl-ethyl)piperazin-1-yl]-2-(3-phenoxyphenyl)ethanone hydrochloride CAS Name: 1-[4-(2-cyclopropylpropan-2-yl)-1-piperazinyl]-2-(3-phenoxyphenyl)ethanone hydrochloride IUPAC Name: 1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]-2-(3-phenoxyphenyl)ethanone hydrochloride Traditional Name: 1-[4-(1-cyclopropyl-1-methyl-ethyl)piperazino]-2-(3-phenoxyphenyl)ethanone hydrochloride Formula: C24H31ClN2O2 MolecularWeight: 414.96814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC1)N2CCN(CC2)C(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4.Cl

Isomeric SMILES

CC(C)(C1CC1)N2CCN(CC2)C(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4.Cl

InChI

InChI=1S/C24H30N2O2.ClH/c1-24(2,20-11-12-20)26-15-13-25(14-16-26)23(27)18-19-7-6-10-22(17-19)28-21-8-4-3-5-9-21;/h3-10,17,20H,11-16,18H2,1-2H3;1H