(2-chloranyl-6-fluoranyl-phenyl)methyl 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoate CAS Name: 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-(4-oxo-1,2,3-benzotriazin-3-yl)propanoate Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C17H13ClFN3O3 MolecularWeight: 361.754823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CCC(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CCC(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H13ClFN3O3/c18-13-5-3-6-14(19)12(13)10-25-16(23)8-9-22-17(24)11-4-1-2-7-15(11)20-21-22/h1-7H,8-10H2