[2-methyl-3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] benzenesulfonate

Systemtic Name: [2-methyl-3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] benzenesulfonate Openeye Name: [2-methyl-3-(1-methyl-4-piperidyl)-1H-indol-5-yl] benzenesulfonate CAS Name: benzenesulfonic acid [2-methyl-3-(1-methyl-4-piperidinyl)-1H-indol-5-yl] ester IUPAC Name: [2-methyl-3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-methyl-3-(1-methyl-4-piperidyl)-1H-indol-5-yl] ester Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OS(=O)(=O)C3=CC=CC=C3)C4CCN(CC4)C

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OS(=O)(=O)C3=CC=CC=C3)C4CCN(CC4)C

InChI

InChI=1S/C21H24N2O3S/c1-15-21(16-10-12-23(2)13-11-16)19-14-17(8-9-20(19)22-15)26-27(24,25)18-6-4-3-5-7-18/h3-9,14,16,22H,10-13H2,1-2H3