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

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 4-ethylbenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C17H15N3O3 MolecularWeight: 309.3193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H15N3O3/c1-2-12-7-9-13(10-8-12)17(22)23-11-20-16(21)14-5-3-4-6-15(14)18-19-20/h3-10H,2,11H2,1H3