methyl 1-[(4-ethyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(4-ethyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(4-ethyl-3-morpholinosulfonyl-benzoyl)amino]cyclohexanecarboxylate CAS Name: 1-[[[4-ethyl-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-ethyl-3-morpholin-4-ylsulfonylbenzoyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(4-ethyl-3-morpholinosulfonyl-benzoyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NC2(CCCCC2)C(=O)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC2(CCCCC2)C(=O)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H30N2O6S/c1-3-16-7-8-17(15-18(16)30(26,27)23-11-13-29-14-12-23)19(24)22-21(20(25)28-2)9-5-4-6-10-21/h7-8,15H,3-6,9-14H2,1-2H3,(H,22,24)