2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)cinchoninic acid 2-phthalimidoethyl ester Formula: C28H22N2O6 MolecularWeight: 482.48408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O)OC

InChI

InChI=1S/C28H22N2O6/c1-34-24-12-11-17(15-25(24)35-2)23-16-21(18-7-5-6-10-22(18)29-23)28(33)36-14-13-30-26(31)19-8-3-4-9-20(19)27(30)32/h3-12,15-16H,13-14H2,1-2H3