1-azanyl-2-(4-nitrophenyl)sulfonyl-propane-1,1,3-tricarboxylic acid

Systemtic Name: 1-azanyl-2-(4-nitrophenyl)sulfonyl-propane-1,1,3-tricarboxylic acid Openeye Name: 1-amino-2-(4-nitrophenyl)sulfonyl-propane-1,1,3-tricarboxylic acid CAS Name: 1-amino-2-(4-nitrophenyl)sulfonylpropane-1,1,3-tricarboxylic acid IUPAC Name: 1-amino-2-(4-nitrophenyl)sulfonylpropane-1,1,3-tricarboxylic acid Traditional Name: 1-amino-2-nosyl-propane-1,1,3-tricarboxylic acid Formula: C12H12N2O10S MolecularWeight: 376.29608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O10S/c13-12(10(17)18,11(19)20)8(5-9(15)16)25(23,24)7-3-1-6(2-4-7)14(21)22/h1-4,8H,5,13H2,(H,15,16)(H,17,18)(H,19,20)