2-azanyl-5-(4-azanylbenzo[e]benzotriazol-2-yl)benzenesulfonic acid

Systemtic Name: 2-azanyl-5-(4-azanylbenzo[e]benzotriazol-2-yl)benzenesulfonic acid Openeye Name: 2-amino-5-(4-aminobenzo[e]benzotriazol-2-yl)benzenesulfonic acid CAS Name: 2-amino-5-(4-amino-2-benzo[e]benzotriazolyl)benzenesulfonic acid IUPAC Name: 2-amino-5-(4-aminobenzo[e]benzotriazol-2-yl)benzenesulfonic acid Traditional Name: 2-amino-5-(4-aminobenzo[e]benzotriazol-2-yl)besylic acid Formula: C16H13N5O3S MolecularWeight: 355.37112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=NN(N=C23)C4=CC(=C(C=C4)N)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=NN(N=C23)C4=CC(=C(C=C4)N)S(=O)(=O)O)N

InChI

InChI=1S/C16H13N5O3S/c17-12-6-5-10(8-14(12)25(22,23)24)21-19-15-11-4-2-1-3-9(11)7-13(18)16(15)20-21/h1-8H,17-18H2,(H,22,23,24)