[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-(benzotriazol-2-yl)ethanoate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 2-(benzotriazol-2-yl)ethanoate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] 2-(benzotriazol-2-yl)acetate CAS Name: 2-(2-benzotriazolyl)acetic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 2-(benzotriazol-2-yl)acetate Traditional Name: 2-(benzotriazol-2-yl)acetic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)CN2N=C3C=CC=CC3=N2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)CN2N=C3C=CC=CC3=N2)Br

InChI

InChI=1S/C17H14BrN3O4/c1-24-16-7-6-11(8-12(16)18)15(22)10-25-17(23)9-21-19-13-4-2-3-5-14(13)20-21/h2-8H,9-10H2,1H3