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

Systemtic Name: 2-phenyl-2-[(5-propan-2-ylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)methyl]piperidin-1-amine hydrochloride Openeye Name: 2-[(5-isopropylsulfonyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine hydrochloride CAS Name: 2-phenyl-2-[(5-propan-2-ylsulfonyl-2,3-dihydrobenzofuran-7-yl)methyl]-1-piperidinamine hydrochloride IUPAC Name: 2-phenyl-2-[(5-propan-2-ylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)methyl]piperidin-1-amine hydrochloride Traditional Name: [2-[(5-isopropylsulfonylcoumaran-7-yl)methyl]-2-phenyl-piperidino]amine hydrochloride Formula: C23H31ClN2O3S MolecularWeight: 451.02184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3S.ClH/c1-17(2)29(26,27)21-14-18-10-13-28-22(18)19(15-21)16-23(11-6-7-12-25(23)24)20-8-4-3-5-9-20;/h3-5,8-9,14-15,17H,6-7,10-13,16,24H2,1-2H3;1H