(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(3-bromanylphenoxy)propanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-(3-bromanylphenoxy)propanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(3-bromophenoxy)propanoate CAS Name: 3-(3-bromophenoxy)propanoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-(3-bromophenoxy)propanoate Traditional Name: 3-(3-bromophenoxy)propionic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCOC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)CCOC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H14BrN3O4/c18-12-4-3-5-13(10-12)24-9-8-16(22)25-11-21-17(23)14-6-1-2-7-15(14)19-20-21/h1-7,10H,8-9,11H2