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

Systemtic Name: (2R,3S)-2-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Openeye Name: (2R,3S)-2-methyl-3-(4-nitrophenyl)-3-(p-tolylsulfonylamino)propanoic acid CAS Name: (2R,3S)-2-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: (2R,3S)-2-methyl-3-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Traditional Name: (2R,3S)-2-methyl-3-(4-nitrophenyl)-3-(tosylamino)propionic acid Formula: C17H18N2O6S MolecularWeight: 378.39962

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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)C(=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)C(=O)O

InChI

InChI=1S/C17H18N2O6S/c1-11-3-9-15(10-4-11)26(24,25)18-16(12(2)17(20)21)13-5-7-14(8-6-13)19(22)23/h3-10,12,16,18H,1-2H3,(H,20,21)/t12-,16+/m1/s1