ethyl 1-[4-[[4-(tert-butylsulfonylamino)cyclohexyl]carbonylamino]phenyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[[4-(tert-butylsulfonylamino)cyclohexyl]carbonylamino]phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]piperidine-4-carboxylate CAS Name: 1-[4-[[[4-(tert-butylsulfonylamino)cyclohexyl]-oxomethyl]amino]phenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]piperidine-4-carboxylate Traditional Name: 1-[4-[[4-(tert-butylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]isonipecotic acid ethyl ester Formula: C25H39N3O5S MolecularWeight: 493.65926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCC(CC3)NS(=O)(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3CCC(CC3)NS(=O)(=O)C(C)(C)C

InChI

InChI=1S/C25H39N3O5S/c1-5-33-24(30)19-14-16-28(17-15-19)22-12-10-20(11-13-22)26-23(29)18-6-8-21(9-7-18)27-34(31,32)25(2,3)4/h10-13,18-19,21,27H,5-9,14-17H2,1-4H3,(H,26,29)