1-(5-chloranyl-1-methyl-indol-3-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one hydrochloride

Systemtic Name: 1-(5-chloranyl-1-methyl-indol-3-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one hydrochloride Openeye Name: 3-(1-benzyl-4-piperidyl)-1-(5-chloro-1-methyl-indol-3-yl)propan-1-one hydrochloride CAS Name: 1-(5-chloro-1-methyl-3-indolyl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone hydrochloride IUPAC Name: 3-(1-benzylpiperidin-4-yl)-1-(5-chloro-1-methylindol-3-yl)propan-1-one hydrochloride Traditional Name: 3-(1-benzyl-4-piperidyl)-1-(5-chloro-1-methyl-indol-3-yl)propan-1-one hydrochloride Formula: C24H28Cl2N2O MolecularWeight: 431.39792

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)Cl)C(=O)CCC3CCN(CC3)CC4=CC=CC=C4.Cl

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)Cl)C(=O)CCC3CCN(CC3)CC4=CC=CC=C4.Cl

InChI

InChI=1S/C24H27ClN2O.ClH/c1-26-17-22(21-15-20(25)8-9-23(21)26)24(28)10-7-18-11-13-27(14-12-18)16-19-5-3-2-4-6-19;/h2-6,8-9,15,17-18H,7,10-14,16H2,1H3;1H