tert-butyl 3-[(4-chlorophenyl)sulfonyl-[1-(4-methoxycarbonylphenyl)ethyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(4-chlorophenyl)sulfonyl-[1-(4-methoxycarbonylphenyl)ethyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-chlorophenyl)sulfonyl-[1-(4-methoxycarbonylphenyl)ethyl]amino]piperidine-1-carboxylate CAS Name: 3-[(4-chlorophenyl)sulfonyl-[1-(4-methoxycarbonylphenyl)ethyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-chlorophenyl)sulfonyl-[1-(4-methoxycarbonylphenyl)ethyl]amino]piperidine-1-carboxylate Traditional Name: 3-[1-(4-carbomethoxyphenyl)ethyl-(4-chlorophenyl)sulfonyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H33ClN2O6S MolecularWeight: 537.06802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)OC)N(C2CCCN(C2)C(=O)OC(C)(C)C)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)OC)N(C2CCCN(C2)C(=O)OC(C)(C)C)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H33ClN2O6S/c1-18(19-8-10-20(11-9-19)24(30)34-5)29(36(32,33)23-14-12-21(27)13-15-23)22-7-6-16-28(17-22)25(31)35-26(2,3)4/h8-15,18,22H,6-7,16-17H2,1-5H3