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

Systemtic Name: tert-butyl 4-[(4-chlorophenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-chlorophenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate CAS Name: 4-[(4-chlorophenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-chlorophenyl)sulfonyl-[(4-methoxycarbonylphenyl)methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[(4-carbomethoxybenzyl)-(4-chlorophenyl)sulfonyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H31ClN2O6S MolecularWeight: 523.04144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H31ClN2O6S/c1-25(2,3)34-24(30)27-15-13-21(14-16-27)28(35(31,32)22-11-9-20(26)10-12-22)17-18-5-7-19(8-6-18)23(29)33-4/h5-12,21H,13-17H2,1-4H3