tert-butyl 4-[[(2-acetyloxyphenyl)-(2-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(2-acetyloxyphenyl)-(2-chlorophenyl)sulfonyl-amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-acetoxy-N-(2-chlorophenyl)sulfonyl-anilino)methyl]piperidine-1-carboxylate CAS Name: 4-[(2-acetyloxy-N-(2-chlorophenyl)sulfonylanilino)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-acetyloxy-N-(2-chlorophenyl)sulfonylanilino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(2-acetoxy-N-(2-chlorophenyl)sulfonyl-anilino)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H31ClN2O6S MolecularWeight: 523.04144

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1N(CC2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)OC1=CC=CC=C1N(CC2CCN(CC2)C(=O)OC(C)(C)C)S(=O)(=O)C3=CC=CC=C3Cl

InChI

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