2-methyl-1-[(2-methylphenyl)methyl]-3-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]indole

Systemtic Name: 2-methyl-1-[(2-methylphenyl)methyl]-3-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]indole Openeye Name: 2-methyl-1-(o-tolylmethyl)-3-[1-(4-propylphenyl)sulfonyl-4-piperidyl]indole CAS Name: 2-methyl-1-[(2-methylphenyl)methyl]-3-[1-(4-propylphenyl)sulfonyl-4-piperidinyl]indole IUPAC Name: 2-methyl-1-[(2-methylphenyl)methyl]-3-[1-(4-propylphenyl)sulfonylpiperidin-4-yl]indole Traditional Name: 2-methyl-1-(2-methylbenzyl)-3-[1-(4-propylphenyl)sulfonyl-4-piperidyl]indole Formula: C31H36N2O2S MolecularWeight: 500.69474

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=CC=CC=C5C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=C(N(C4=CC=CC=C43)CC5=CC=CC=C5C)C

InChI

InChI=1S/C31H36N2O2S/c1-4-9-25-14-16-28(17-15-25)36(34,35)32-20-18-26(19-21-32)31-24(3)33(30-13-8-7-12-29(30)31)22-27-11-6-5-10-23(27)2/h5-8,10-17,26H,4,9,18-22H2,1-3H3