1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(phenylsulfonyl)piperidin-4-yl]indole

Systemtic Name: 1-[(3-fluorophenyl)methyl]-2-methyl-3-[1-(phenylsulfonyl)piperidin-4-yl]indole Openeye Name: 3-[1-(benzenesulfonyl)-4-piperidyl]-1-[(3-fluorophenyl)methyl]-2-methyl-indole CAS Name: 3-[1-(benzenesulfonyl)-4-piperidinyl]-1-[(3-fluorophenyl)methyl]-2-methylindole IUPAC Name: 3-[1-(benzenesulfonyl)piperidin-4-yl]-1-[(3-fluorophenyl)methyl]-2-methylindole Traditional Name: 3-(1-besyl-4-piperidyl)-1-(3-fluorobenzyl)-2-methyl-indole Formula: C27H27FN2O2S MolecularWeight: 462.578883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)F)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)F)C4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H27FN2O2S/c1-20-27(22-14-16-29(17-15-22)33(31,32)24-10-3-2-4-11-24)25-12-5-6-13-26(25)30(20)19-21-8-7-9-23(28)18-21/h2-13,18,22H,14-17,19H2,1H3