tert-butyl 2-(ethylamino)-1-[4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidine-4-carboxylate

Systemtic Name: tert-butyl 2-(ethylamino)-1-[4-[methyl(phenylsulfonyl)amino]-3-phenyl-butyl]piperidine-4-carboxylate Openeye Name: tert-butyl 1-[4-[benzenesulfonyl(methyl)amino]-3-phenyl-butyl]-2-(ethylamino)piperidine-4-carboxylate CAS Name: 1-[4-[benzenesulfonyl(methyl)amino]-3-phenylbutyl]-2-(ethylamino)-4-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[4-[benzenesulfonyl(methyl)amino]-3-phenylbutyl]-2-(ethylamino)piperidine-4-carboxylate Traditional Name: 1-[4-[besyl(methyl)amino]-3-phenyl-butyl]-2-(ethylamino)isonipecotic acid tert-butyl ester Formula: C29H43N3O4S MolecularWeight: 529.73442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1CC(CCN1CCC(CN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CCNC1CC(CCN1CCC(CN(C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H43N3O4S/c1-6-30-27-21-24(28(33)36-29(2,3)4)17-19-32(27)20-18-25(23-13-9-7-10-14-23)22-31(5)37(34,35)26-15-11-8-12-16-26/h7-16,24-25,27,30H,6,17-22H2,1-5H3