3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[4-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-keto-butyl]-1,2,3-benzotriazin-4-one Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CCCN3C(=O)C4=CC=CC=C4N=N3)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CCCN3C(=O)C4=CC=CC=C4N=N3)OC

InChI

InChI=1S/C22H24N4O4/c1-29-19-12-15-9-11-25(14-16(15)13-20(19)30-2)21(27)8-5-10-26-22(28)17-6-3-4-7-18(17)23-24-26/h3-4,6-7,12-13H,5,8-11,14H2,1-2H3