(3-methoxy-8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-2-yl) benzoate

Systemtic Name: (3-methoxy-8-oxidanylidene-5,6-dihydroisoquinolino[2,1-b]isoquinolin-2-yl) benzoate Openeye Name: (3-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-2-yl) benzoate CAS Name: benzoic acid (3-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-2-yl) ester IUPAC Name: (3-methoxy-8-oxo-5,6-dihydroisoquinolino[2,1-b]isoquinolin-2-yl) benzoate Traditional Name: benzoic acid (8-keto-3-methoxy-5,6-dihydroisoquinolin[2,1-b]isoquinolin-2-yl) ester Formula: C25H19NO4 MolecularWeight: 397.42266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC4=CC=CC=C4C3=O)OC(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC4=CC=CC=C4C3=O)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H19NO4/c1-29-22-14-18-11-12-26-21(13-17-9-5-6-10-19(17)24(26)27)20(18)15-23(22)30-25(28)16-7-3-2-4-8-16/h2-10,13-15H,11-12H2,1H3