(2-oxidanyl-2-phenyl-ethyl) 1,2,3-benzothiadiazole-7-carboxylate

Systemtic Name: (2-oxidanyl-2-phenyl-ethyl) 1,2,3-benzothiadiazole-7-carboxylate Openeye Name: (2-hydroxy-2-phenyl-ethyl) 1,2,3-benzothiadiazole-7-carboxylate CAS Name: 1,2,3-benzothiadiazole-7-carboxylic acid (2-hydroxy-2-phenylethyl) ester IUPAC Name: (2-hydroxy-2-phenylethyl) 1,2,3-benzothiadiazole-7-carboxylate Traditional Name: 1,2,3-benzothiadiazole-7-carboxylic acid (2-hydroxy-2-phenyl-ethyl) ester Formula: C15H12N2O3S MolecularWeight: 300.33238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(COC(=O)C2=C3C(=CC=C2)N=NS3)O

Isomeric SMILES

C1=CC=C(C=C1)C(COC(=O)C2=C3C(=CC=C2)N=NS3)O

InChI

InChI=1S/C15H12N2O3S/c18-13(10-5-2-1-3-6-10)9-20-15(19)11-7-4-8-12-14(11)21-17-16-12/h1-8,13,18H,9H2