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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(4-methylphenyl)quinoline-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(p-tolyl)quinoline-4-carboxylate CAS Name: 2-(4-methylphenyl)-4-quinolinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(4-methylphenyl)quinoline-4-carboxylate Traditional Name: 2-(p-tolyl)cinchoninic acid 2-phthalimidoethyl ester Formula: C27H20N2O4 MolecularWeight: 436.4587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C27H20N2O4/c1-17-10-12-18(13-11-17)24-16-22(19-6-4-5-9-23(19)28-24)27(32)33-15-14-29-25(30)20-7-2-3-8-21(20)26(29)31/h2-13,16H,14-15H2,1H3