2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-oxidanylidene-phthalazin-2-ium-2-yl]ethanal

Systemtic Name: 2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-oxidanylidene-phthalazin-2-ium-2-yl]ethanal Openeye Name: 2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-oxo-phthalazin-2-ium-2-yl]acetaldehyde CAS Name: 2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-oxo-2-phthalazin-2-iumyl]acetaldehyde IUPAC Name: 2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-oxophthalazin-2-ium-2-yl]acetaldehyde Traditional Name: 2-[2-(2,5-dimethoxyphenyl)-4-(3,4-dimethoxyphenyl)-1-keto-phthalazin-2-ium-2-yl]acetaldehyde Formula: C26H25N2O6+ MolecularWeight: 461.4865

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H25N2O6/c1-31-18-10-12-22(32-2)21(16-18)28(13-14-29)26(30)20-8-6-5-7-19(20)25(27-28)17-9-11-23(33-3)24(15-17)34-4/h5-12,14-16H,13H2,1-4H3/q+1