2-[(5-methylsulfinyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine hydrochloride

Systemtic Name: 2-[(5-methylsulfinyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine hydrochloride Openeye Name: 2-[(5-methylsulfinyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine hydrochloride CAS Name: 2-[(5-methylsulfinyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-1-piperidinamine hydrochloride IUPAC Name: 2-[(5-methylsulfinyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenylpiperidin-1-amine hydrochloride Traditional Name: [2-[(5-methylsulfinylcoumaran-7-yl)methyl]-2-phenyl-piperidino]amine hydrochloride Formula: C21H27ClN2O2S MolecularWeight: 406.96928

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC(=C2C(=C1)CCO2)CC3(CCCCN3N)C4=CC=CC=C4.Cl

Isomeric SMILES

CS(=O)C1=CC(=C2C(=C1)CCO2)CC3(CCCCN3N)C4=CC=CC=C4.Cl

InChI

InChI=1S/C21H26N2O2S.ClH/c1-26(24)19-13-16-9-12-25-20(16)17(14-19)15-21(10-5-6-11-23(21)22)18-7-3-2-4-8-18;/h2-4,7-8,13-14H,5-6,9-12,15,22H2,1H3;1H