[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-methylphenyl)sulfonylamino]benzoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-methylphenyl)sulfonylamino]benzoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-(p-tolylsulfonylamino)benzoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]benzoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-[(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 3-(tosylamino)benzoic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5S/c1-4-20-18(22)14(3)26-19(23)15-6-5-7-16(12-15)21-27(24,25)17-10-8-13(2)9-11-17/h5-12,14,21H,4H2,1-3H3,(H,20,22)/t14-/m0/s1