2-(4-azanyl-3-nitro-phenyl)benzenesulfinic acid

Systemtic Name: 2-(4-azanyl-3-nitro-phenyl)benzenesulfinic acid Openeye Name: 2-(4-amino-3-nitro-phenyl)benzenesulfinic acid CAS Name: 2-(4-amino-3-nitrophenyl)benzenesulfinic acid IUPAC Name: 2-(4-amino-3-nitrophenyl)benzenesulfinic acid Traditional Name: 2-(4-amino-3-nitro-phenyl)benzenesulfinic acid Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O4S/c13-10-6-5-8(7-11(10)14(15)16)9-3-1-2-4-12(9)19(17)18/h1-7H,13H2,(H,17,18)