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

Systemtic Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenyl-piperidin-1-amine dihydrochloride Openeye Name: N-[(5-methoxy-1-methylsulfonyl-indolin-6-yl)methyl]-2-phenyl-piperidin-1-amine dihydrochloride CAS Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenyl-1-piperidinamine dihydrochloride IUPAC Name: N-[(5-methoxy-1-methylsulfonyl-2,3-dihydroindol-6-yl)methyl]-2-phenylpiperidin-1-amine dihydrochloride Traditional Name: (1-mesyl-5-methoxy-indolin-6-yl)methyl-(2-phenylpiperidino)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)CNN3CCCCC3C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN2S(=O)(=O)C)CNN3CCCCC3C4=CC=CC=C4.Cl.Cl

InChI

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