4-[4-(benzotriazol-1-yl)phenyl]sulfonylbenzoic acid

Systemtic Name: 4-[4-(benzotriazol-1-yl)phenyl]sulfonylbenzoic acid Openeye Name: 4-[4-(benzotriazol-1-yl)phenyl]sulfonylbenzoic acid CAS Name: 4-[4-(1-benzotriazolyl)phenyl]sulfonylbenzoic acid IUPAC Name: 4-[4-(benzotriazol-1-yl)phenyl]sulfonylbenzoic acid Traditional Name: 4-[4-(benzotriazol-1-yl)phenyl]sulfonylbenzoic acid Formula: C19H13N3O4S MolecularWeight: 379.38922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H13N3O4S/c23-19(24)13-5-9-15(10-6-13)27(25,26)16-11-7-14(8-12-16)22-18-4-2-1-3-17(18)20-21-22/h1-12H,(H,23,24)