methyl 1-[(4-methylsulfonylphenyl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[(4-methylsulfonylphenyl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(4-methylsulfonylbenzoyl)amino]cyclohexanecarboxylate CAS Name: 1-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4-methylsulfonylbenzoyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(4-mesylbenzoyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H21NO5S/c1-22-15(19)16(10-4-3-5-11-16)17-14(18)12-6-8-13(9-7-12)23(2,20)21/h6-9H,3-5,10-11H2,1-2H3,(H,17,18)