[4-(1,2,3,4-tetrazol-1-yl)phenyl] naphthalene-2-sulfonate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] naphthalene-2-sulfonate Openeye Name: [4-(tetrazol-1-yl)phenyl] naphthalene-2-sulfonate CAS Name: 2-naphthalenesulfonic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] naphthalene-2-sulfonate Traditional Name: naphthalene-2-sulfonic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C17H12N4O3S MolecularWeight: 352.36718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)OC3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)OC3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C17H12N4O3S/c22-25(23,17-10-5-13-3-1-2-4-14(13)11-17)24-16-8-6-15(7-9-16)21-12-18-19-20-21/h1-12H