tert-butyl 3-[(4-tert-butylphenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-tert-butylphenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-tert-butylphenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate CAS Name: 3-[(4-tert-butylphenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-tert-butylphenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate Traditional Name: 3-[(4-tert-butylphenyl)sulfonyl-(4-carbomethoxybenzyl)amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H40N2O6S MolecularWeight: 544.7027

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)OC)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)OC)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H40N2O6S/c1-28(2,3)23-14-16-25(17-15-23)38(34,35)31(19-21-10-12-22(13-11-21)26(32)36-7)24-9-8-18-30(20-24)27(33)37-29(4,5)6/h10-17,24H,8-9,18-20H2,1-7H3