1-[2-(4-methylphenyl)sulfonylethyl]-3-[(1-methylpyrrolidin-2-yl)methyl]indole

Systemtic Name: 1-[2-(4-methylphenyl)sulfonylethyl]-3-[(1-methylpyrrolidin-2-yl)methyl]indole Openeye Name: 3-[(1-methylpyrrolidin-2-yl)methyl]-1-[2-(p-tolylsulfonyl)ethyl]indole CAS Name: 1-[2-(4-methylphenyl)sulfonylethyl]-3-[(1-methyl-2-pyrrolidinyl)methyl]indole IUPAC Name: 1-[2-(4-methylphenyl)sulfonylethyl]-3-[(1-methylpyrrolidin-2-yl)methyl]indole Traditional Name: 3-[(1-methylpyrrolidin-2-yl)methyl]-1-(2-tosylethyl)indole Formula: C23H28N2O2S MolecularWeight: 396.54562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCN2C=C(C3=CC=CC=C32)CC4CCCN4C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCN2C=C(C3=CC=CC=C32)CC4CCCN4C

InChI

InChI=1S/C23H28N2O2S/c1-18-9-11-21(12-10-18)28(26,27)15-14-25-17-19(16-20-6-5-13-24(20)2)22-7-3-4-8-23(22)25/h3-4,7-12,17,20H,5-6,13-16H2,1-2H3