2-[methyl-(phenylmethyl)sulfonyl-amino]-4-oxidanylidene-4-phenylmethoxy-butanoic acid

Systemtic Name: 2-[methyl-(phenylmethyl)sulfonyl-amino]-4-oxidanylidene-4-phenylmethoxy-butanoic acid Openeye Name: 4-benzyloxy-2-[benzylsulfonyl(methyl)amino]-4-oxo-butanoic acid CAS Name: 2-[methyl-(phenylmethyl)sulfonylamino]-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: 2-[benzylsulfonyl(methyl)amino]-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: 4-benzoxy-2-[benzylsulfonyl(methyl)amino]-4-keto-butyric acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC(=O)OCC1=CC=CC=C1)C(=O)O)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CN(C(CC(=O)OCC1=CC=CC=C1)C(=O)O)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C19H21NO6S/c1-20(27(24,25)14-16-10-6-3-7-11-16)17(19(22)23)12-18(21)26-13-15-8-4-2-5-9-15/h2-11,17H,12-14H2,1H3,(H,22,23)