(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H10FN3O3S MolecularWeight: 355.343003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C17H10FN3O3S/c18-12-5-3-7-14-11(12)8-15(25-14)17(23)24-9-21-16(22)10-4-1-2-6-13(10)19-20-21/h1-8H,9H2