[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] (2S)-2-[(4-methoxyphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]propionic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C(C)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)[C@H](C)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H24N2O6S/c1-14-6-4-5-7-16(14)12-21-19(23)13-28-20(24)15(2)22-29(25,26)18-10-8-17(27-3)9-11-18/h4-11,15,22H,12-13H2,1-3H3,(H,21,23)/t15-/m0/s1