[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-[(4-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl] 3-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetylphenyl)sulfonylamino]propanoic acid [(2R)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl] 3-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]propionic acid [(1R)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)OC(=O)CCNS(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C20H22N2O6S/c1-14(23)16-8-10-18(11-9-16)29(26,27)21-13-12-19(24)28-15(2)20(25)22-17-6-4-3-5-7-17/h3-11,15,21H,12-13H2,1-2H3,(H,22,25)/t15-/m1/s1