(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H12N4O4 MolecularWeight: 336.30158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12N4O4/c18-9-12-5-7-13(8-6-12)24-10-16(22)25-11-21-17(23)14-3-1-2-4-15(14)19-20-21/h1-8H,10-11H2