ethyl 3-[4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoylamino]benzoate

Systemtic Name: ethyl 3-[4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoylamino]benzoate Openeye Name: ethyl 3-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]benzoate CAS Name: 3-[[1-oxo-4-(4-oxo-1,2,3-benzotriazin-3-yl)butyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoylamino]benzoate Traditional Name: 3-[4-(4-keto-1,2,3-benzotriazin-3-yl)butanoylamino]benzoic acid ethyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C20H20N4O4/c1-2-28-20(27)14-7-5-8-15(13-14)21-18(25)11-6-12-24-19(26)16-9-3-4-10-17(16)22-23-24/h3-5,7-10,13H,2,6,11-12H2,1H3,(H,21,25)