[2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate

Systemtic Name: [2-[(2-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 3-methyl-2-(phenylsulfonylamino)butanoate Openeye Name: [2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 2-(benzenesulfonamido)-3-methyl-butanoate CAS Name: 2-(benzenesulfonamido)-3-methylbutanoic acid [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylcyclohexyl)amino]-2-oxoethyl] 2-(benzenesulfonamido)-3-methylbutanoate Traditional Name: 2-(benzenesulfonamido)-3-methyl-butyric acid [2-keto-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)COC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CCCCC1NC(=O)COC(=O)C(C(C)C)NS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H30N2O5S/c1-14(2)19(22-28(25,26)16-10-5-4-6-11-16)20(24)27-13-18(23)21-17-12-8-7-9-15(17)3/h4-6,10-11,14-15,17,19,22H,7-9,12-13H2,1-3H3,(H,21,23)