3-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)oxy]-4-methoxy-benzaldehyde

Systemtic Name: 3-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)oxy]-4-methoxy-benzaldehyde Openeye Name: 3-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)oxy]-4-methoxy-benzaldehyde CAS Name: 3-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)oxy]-4-methoxybenzaldehyde IUPAC Name: 3-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)oxy]-4-methoxybenzaldehyde Traditional Name: 3-[(4-keto-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-2-yl)oxy]-4-methoxy-benzaldehyde Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)OC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

InChI

InChI=1S/C22H20N2O6/c1-27-17-5-4-13(12-25)8-20(17)30-21-11-16-15-10-19(29-3)18(28-2)9-14(15)6-7-24(16)22(26)23-21/h4-5,8-12H,6-7H2,1-3H3