1-[(3-methoxyphenyl)methyl]-2-methyl-3-[1-(phenylmethyl)sulfonylpiperidin-4-yl]indole

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-2-methyl-3-[1-(phenylmethyl)sulfonylpiperidin-4-yl]indole Openeye Name: 3-(1-benzylsulfonyl-4-piperidyl)-1-[(3-methoxyphenyl)methyl]-2-methyl-indole CAS Name: 1-[(3-methoxyphenyl)methyl]-2-methyl-3-[1-(phenylmethyl)sulfonyl-4-piperidinyl]indole IUPAC Name: 3-(1-benzylsulfonylpiperidin-4-yl)-1-[(3-methoxyphenyl)methyl]-2-methylindole Traditional Name: 3-(1-benzylsulfonyl-4-piperidyl)-1-m-anisyl-2-methyl-indole Formula: C29H32N2O3S MolecularWeight: 488.64098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC(=CC=C3)OC)C4CCN(CC4)S(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N2O3S/c1-22-29(25-15-17-30(18-16-25)35(32,33)21-23-9-4-3-5-10-23)27-13-6-7-14-28(27)31(22)20-24-11-8-12-26(19-24)34-2/h3-14,19,25H,15-18,20-21H2,1-2H3