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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCCN4C(=O)C5=CC=CC=C5C4=O

InChI

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