(2R)-2-(carboxycarbonylamino)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]propanoic acid

Systemtic Name: (2R)-2-(carboxycarbonylamino)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]propanoic acid Openeye Name: (2R)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]-2-(oxaloamino)propanoic acid CAS Name: (2R)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]-2-(oxaloamino)propanoic acid IUPAC Name: (2R)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]-2-(oxaloamino)propanoic acid Traditional Name: (2R)-3-[4-(2-nitrophenyl)sulfonyloxyphenyl]-2-(oxaloamino)propionic acid Formula: C17H14N2O10S MolecularWeight: 438.36546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)CC(C(=O)O)NC(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)OC2=CC=C(C=C2)C[C@H](C(=O)O)NC(=O)C(=O)O

InChI

InChI=1S/C17H14N2O10S/c20-15(17(23)24)18-12(16(21)22)9-10-5-7-11(8-6-10)29-30(27,28)14-4-2-1-3-13(14)19(25)26/h1-8,12H,9H2,(H,18,20)(H,21,22)(H,23,24)/t12-/m1/s1