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

Systemtic Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Openeye Name: (2S)-3-(4-nitrophenyl)-2-(p-tolylsulfonylamino)propanoic acid CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid IUPAC Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-3-(4-nitrophenyl)propanoic acid Traditional Name: (2S)-3-(4-nitrophenyl)-2-(tosylamino)propionic acid Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H16N2O6S/c1-11-2-8-14(9-3-11)25(23,24)17-15(16(19)20)10-12-4-6-13(7-5-12)18(21)22/h2-9,15,17H,10H2,1H3,(H,19,20)/t15-/m0/s1