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

Systemtic Name: tert-butyl 3-[(4-methoxycarbonylphenyl)methyl-[4-(trifluoromethyl)phenyl]sulfonyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(4-methoxycarbonylphenyl)methyl-[4-(trifluoromethyl)phenyl]sulfonyl-amino]piperidine-1-carboxylate CAS Name: 3-[(4-methoxycarbonylphenyl)methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(4-methoxycarbonylphenyl)methyl-[4-(trifluoromethyl)phenyl]sulfonylamino]piperidine-1-carboxylate Traditional Name: 3-[(4-carbomethoxybenzyl)-[4-(trifluoromethyl)phenyl]sulfonyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31F3N2O6S MolecularWeight: 556.59435

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C26H31F3N2O6S/c1-25(2,3)37-24(33)30-15-5-6-21(17-30)31(16-18-7-9-19(10-8-18)23(32)36-4)38(34,35)22-13-11-20(12-14-22)26(27,28)29/h7-14,21H,5-6,15-17H2,1-4H3