(2R,3S)-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)-2-oxidanyl-propanoic acid

Systemtic Name: (2R,3S)-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)-2-oxidanyl-propanoic acid Openeye Name: (2R,3S)-2-hydroxy-3-(4-nitrophenyl)-3-(p-tolylsulfonylamino)propanoic acid CAS Name: (2R,3S)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: (2R,3S)-2-hydroxy-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Traditional Name: (2R,3S)-2-hydroxy-3-(4-nitrophenyl)-3-(tosylamino)propionic acid Formula: C16H16N2O7S MolecularWeight: 380.37244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=C(C=C2)[N+](=O)[O-])C(C(=O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O7S/c1-10-2-8-13(9-3-10)26(24,25)17-14(15(19)16(20)21)11-4-6-12(7-5-11)18(22)23/h2-9,14-15,17,19H,1H3,(H,20,21)/t14-,15+/m0/s1