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

Systemtic Name: [(2R)-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Openeye Name: [(1R)-2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propanoic acid [(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] 3-[(3,4-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(3,4-dimethylphenyl)sulfonylamino]propionic acid [(1R)-2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl] ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OC(C)C(=O)C2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)O[C@H](C)C(=O)C2=CC=C(C=C2)OC)C

InChI

InChI=1S/C21H25NO6S/c1-14-5-10-19(13-15(14)2)29(25,26)22-12-11-20(23)28-16(3)21(24)17-6-8-18(27-4)9-7-17/h5-10,13,16,22H,11-12H2,1-4H3/t16-/m1/s1