methyl 4,5-dimethoxy-2-[6-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)hexanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[6-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)hexanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[1-oxo-6-(4-oxo-1,2,3-benzotriazin-3-yl)hexyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[6-(4-oxo-1,2,3-benzotriazin-3-yl)hexanoylamino]benzoate Traditional Name: 2-[6-(4-keto-1,2,3-benzotriazin-3-yl)hexanoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C23H26N4O6 MolecularWeight: 454.47574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3N=N2)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3N=N2)OC

InChI

InChI=1S/C23H26N4O6/c1-31-19-13-16(23(30)33-3)18(14-20(19)32-2)24-21(28)11-5-4-8-12-27-22(29)15-9-6-7-10-17(15)25-26-27/h6-7,9-10,13-14H,4-5,8,11-12H2,1-3H3,(H,24,28)