2-[4-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-phthalazin-2-ium-2-yl]ethanal

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxidanylidene-phthalazin-2-ium-2-yl]ethanal Openeye Name: 2-[4-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxo-phthalazin-2-ium-2-yl]acetaldehyde CAS Name: 2-[4-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxo-2-phthalazin-2-iumyl]acetaldehyde IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-oxophthalazin-2-ium-2-yl]acetaldehyde Traditional Name: 2-[4-(3,4-dimethoxyphenyl)-1-keto-2-(4-methoxyphenyl)phthalazin-2-ium-2-yl]acetaldehyde Formula: C25H23N2O5+ MolecularWeight: 431.46052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2(C(=O)C3=CC=CC=C3C(=N2)C4=CC(=C(C=C4)OC)OC)CC=O

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2(C(=O)C3=CC=CC=C3C(=N2)C4=CC(=C(C=C4)OC)OC)CC=O

InChI

InChI=1S/C25H23N2O5/c1-30-19-11-9-18(10-12-19)27(14-15-28)25(29)21-7-5-4-6-20(21)24(26-27)17-8-13-22(31-2)23(16-17)32-3/h4-13,15-16H,14H2,1-3H3/q+1