[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-ethylsulfonylbenzoate

Systemtic Name: [(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-ethylsulfonylbenzoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid [(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-phenyl-ethyl] ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)CC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)OC(=O)C2=CC=CC=C2S(=O)(=O)CC

InChI

InChI=1S/C20H22N2O6S/c1-3-21-20(25)22-18(23)17(14-10-6-5-7-11-14)28-19(24)15-12-8-9-13-16(15)29(26,27)4-2/h5-13,17H,3-4H2,1-2H3,(H2,21,22,23,25)/t17-/m0/s1