2-(4-nitrophenyl)benzo[e]benzotriazole-5-sulfonic acid

Systemtic Name: 2-(4-nitrophenyl)benzo[e]benzotriazole-5-sulfonic acid Openeye Name: 2-(4-nitrophenyl)benzo[e]benzotriazole-5-sulfonic acid CAS Name: 2-(4-nitrophenyl)-5-benzo[e]benzotriazolesulfonic acid IUPAC Name: 2-(4-nitrophenyl)benzo[e]benzotriazole-5-sulfonic acid Traditional Name: 2-(4-nitrophenyl)benzo[e]benzotriazole-5-sulfonic acid Formula: C16H10N4O5S MolecularWeight: 370.3394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC3=NN(N=C23)C4=CC=C(C=C4)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C16H10N4O5S/c21-20(22)11-7-5-10(6-8-11)19-17-14-9-15(26(23,24)25)12-3-1-2-4-13(12)16(14)18-19/h1-9H,(H,23,24,25)