N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-methoxy-N-phenethyl-benzenesulfonamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-methoxy-N-phenethyl-benzenesulfonamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-3-methoxy-N-phenethyl-benzenesulfonamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-3-methoxy-N-phenethylbenzenesulfonamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-methoxy-N-phenethylbenzenesulfonamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-3-methoxy-N-phenethyl-benzenesulfonamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)N(CCC2=CC=CC=C2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)N(CCC2=CC=CC=C2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C28H31N3O3S/c1-34-27-11-6-12-28(20-27)35(32,33)31(18-13-23-7-3-2-4-8-23)26-14-16-30(17-15-26)22-25-10-5-9-24(19-25)21-29/h2-12,19-20,26H,13-18,22H2,1H3