phenacyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-7-chloranyl-8-methyl-quinoline-4-carboxylate

Systemtic Name: phenacyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]-7-chloranyl-8-methyl-quinoline-4-carboxylate Openeye Name: phenacyl 7-chloro-2-[4-(1,3-dioxoisoindolin-2-yl)phenyl]-8-methyl-quinoline-4-carboxylate CAS Name: 7-chloro-2-[4-(1,3-dioxo-2-isoindolyl)phenyl]-8-methyl-4-quinolinecarboxylic acid phenacyl ester IUPAC Name: phenacyl 7-chloro-2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-8-methylquinoline-4-carboxylate Traditional Name: 7-chloro-8-methyl-2-(4-phthalimidophenyl)cinchoninic acid phenacyl ester Formula: C33H21ClN2O5 MolecularWeight: 560.98324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)N5C(=O)C6=CC=CC=C6C5=O)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)OCC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)N5C(=O)C6=CC=CC=C6C5=O)Cl

InChI

InChI=1S/C33H21ClN2O5/c1-19-27(34)16-15-23-26(33(40)41-18-29(37)21-7-3-2-4-8-21)17-28(35-30(19)23)20-11-13-22(14-12-20)36-31(38)24-9-5-6-10-25(24)32(36)39/h2-17H,18H2,1H3