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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=N[N+](C(=O)C3=CC=CC=C32)(CC=O)C4=CC=CC=C4OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=N[N+](C(=O)C3=CC=CC=C32)(CC=O)C4=CC=CC=C4OC)OC

InChI

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