3-(5-chloranyl-1-benzofuran-3-yl)-1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]propan-1-one hydrochloride

Systemtic Name: 3-(5-chloranyl-1-benzofuran-3-yl)-1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]propan-1-one hydrochloride Openeye Name: 3-(5-chlorobenzofuran-3-yl)-1-[4-(1-cyclopropyl-1-methyl-ethyl)piperazin-1-yl]propan-1-one hydrochloride CAS Name: 3-(5-chloro-3-benzofuranyl)-1-[4-(2-cyclopropylpropan-2-yl)-1-piperazinyl]-1-propanone hydrochloride IUPAC Name: 3-(5-chloro-1-benzofuran-3-yl)-1-[4-(2-cyclopropylpropan-2-yl)piperazin-1-yl]propan-1-one hydrochloride Traditional Name: 3-(5-chlorobenzofuran-3-yl)-1-[4-(1-cyclopropyl-1-methyl-ethyl)piperazino]propan-1-one hydrochloride Formula: C21H28Cl2N2O2 MolecularWeight: 411.36522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC1)N2CCN(CC2)C(=O)CCC3=COC4=C3C=C(C=C4)Cl.Cl

Isomeric SMILES

CC(C)(C1CC1)N2CCN(CC2)C(=O)CCC3=COC4=C3C=C(C=C4)Cl.Cl

InChI

InChI=1S/C21H27ClN2O2.ClH/c1-21(2,16-4-5-16)24-11-9-23(10-12-24)20(25)8-3-15-14-26-19-7-6-17(22)13-18(15)19;/h6-7,13-14,16H,3-5,8-12H2,1-2H3;1H