[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate CAS Name: 4-[(3,4-dimethylphenyl)sulfonylamino]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(3,4-dimethylphenyl)sulfonylamino]benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OC(C)C(=O)NC3CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)O[C@H](C)C(=O)NC3CC3)C

InChI

InChI=1S/C21H24N2O5S/c1-13-4-11-19(12-14(13)2)29(26,27)23-18-7-5-16(6-8-18)21(25)28-15(3)20(24)22-17-9-10-17/h4-8,11-12,15,17,23H,9-10H2,1-3H3,(H,22,24)/t15-/m1/s1