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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)OC4=C(C=C(C=C4)C=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)OC4=C(C=C(C=C4)C=O)OC)OC

InChI

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