(2S,3S)-3-(4-methoxyphenyl)carbonyloxy-2-[(4-methylphenyl)sulfonylamino]butanoic acid

Systemtic Name: (2S,3S)-3-(4-methoxyphenyl)carbonyloxy-2-[(4-methylphenyl)sulfonylamino]butanoic acid Openeye Name: (2S,3S)-3-(4-methoxybenzoyl)oxy-2-(p-tolylsulfonylamino)butanoic acid CAS Name: (2S,3S)-3-[(4-methoxyphenyl)-oxomethoxy]-2-[(4-methylphenyl)sulfonylamino]butanoic acid IUPAC Name: (2S,3S)-3-(4-methoxybenzoyl)oxy-2-[(4-methylphenyl)sulfonylamino]butanoic acid Traditional Name: (2S,3S)-3-p-anisoyloxy-2-(tosylamino)butyric acid Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO7S/c1-12-4-10-16(11-5-12)28(24,25)20-17(18(21)22)13(2)27-19(23)14-6-8-15(26-3)9-7-14/h4-11,13,17,20H,1-3H3,(H,21,22)/t13-,17-/m0/s1