(3R)-3-(2-chloranyl-5-nitro-phenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid

Systemtic Name: (3R)-3-(2-chloranyl-5-nitro-phenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid Openeye Name: (3R)-3-(benzylsulfonylamino)-3-(2-chloro-5-nitro-phenyl)propanoic acid CAS Name: (3R)-3-(2-chloro-5-nitrophenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid IUPAC Name: (3R)-3-(benzylsulfonylamino)-3-(2-chloro-5-nitrophenyl)propanoic acid Traditional Name: (3R)-3-(benzylsulfonylamino)-3-(2-chloro-5-nitro-phenyl)propionic acid Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC(CC(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)N[C@H](CC(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15ClN2O6S/c17-14-7-6-12(19(22)23)8-13(14)15(9-16(20)21)18-26(24,25)10-11-4-2-1-3-5-11/h1-8,15,18H,9-10H2,(H,20,21)/t15-/m1/s1