N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride

Systemtic Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride Openeye Name: N-[(5-methoxy-1-methylsulfonyl-indolin-6-yl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride CAS Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenyl-3-piperidinamine dihydrochloride IUPAC Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenylpiperidin-3-amine dihydrochloride Traditional Name: (1-mesyl-5-methoxy-indolin-6-yl)methyl-(2-phenyl-3-piperidyl)amine dihydrochloride Formula: C22H31Cl2N3O3S MolecularWeight: 488.47084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN2S(=O)(=O)C)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN2S(=O)(=O)C)CNC3CCCNC3C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C22H29N3O3S.2ClH/c1-28-21-14-17-10-12-25(29(2,26)27)20(17)13-18(21)15-24-19-9-6-11-23-22(19)16-7-4-3-5-8-16;;/h3-5,7-8,13-14,19,22-24H,6,9-12,15H2,1-2H3;2*1H