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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(3,4-dimethoxyphenyl)-4-quinolinecarboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-(3,4-dimethoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(3,4-dimethoxyphenyl)cinchoninic acid phthalimidomethyl ester Formula: C27H20N2O6 MolecularWeight: 468.4575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCN4C(=O)C5=CC=CC=C5C4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCN4C(=O)C5=CC=CC=C5C4=O)OC

InChI

InChI=1S/C27H20N2O6/c1-33-23-12-11-16(13-24(23)34-2)22-14-20(17-7-5-6-10-21(17)28-22)27(32)35-15-29-25(30)18-8-3-4-9-19(18)26(29)31/h3-14H,15H2,1-2H3