1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]benzimidazole-2-sulfonic acid

Systemtic Name: 1-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]benzimidazole-2-sulfonic acid Openeye Name: 1-[2-(2-nitroanilino)-2-oxo-ethyl]benzimidazole-2-sulfonic acid CAS Name: 1-[2-(2-nitroanilino)-2-oxoethyl]-2-benzimidazolesulfonic acid IUPAC Name: 1-[2-(2-nitroanilino)-2-oxoethyl]benzimidazole-2-sulfonic acid Traditional Name: 1-[2-keto-2-(2-nitroanilino)ethyl]benzimidazole-2-sulfonic acid Formula: C15H12N4O6S MolecularWeight: 376.34398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC(=O)NC3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC(=O)NC3=CC=CC=C3[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C15H12N4O6S/c20-14(16-11-6-2-4-8-13(11)19(21)22)9-18-12-7-3-1-5-10(12)17-15(18)26(23,24)25/h1-8H,9H2,(H,16,20)(H,23,24,25)