2-azanyl-3-(4-nitrophenyl)sulfonyl-benzoic acid

Systemtic Name: 2-azanyl-3-(4-nitrophenyl)sulfonyl-benzoic acid Openeye Name: 2-amino-3-(4-nitrophenyl)sulfonyl-benzoic acid CAS Name: 2-amino-3-(4-nitrophenyl)sulfonylbenzoic acid IUPAC Name: 2-amino-3-(4-nitrophenyl)sulfonylbenzoic acid Traditional Name: 2-amino-3-nosyl-benzoic acid Formula: C13H10N2O6S MolecularWeight: 322.2933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O6S/c14-12-10(13(16)17)2-1-3-11(12)22(20,21)9-6-4-8(5-7-9)15(18)19/h1-7H,14H2,(H,16,17)