quinolin-8-yl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate

Systemtic Name: quinolin-8-yl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate Openeye Name: 8-quinolyl 2-(4-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carboxylate CAS Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-4-quinolinecarboxylic acid 8-quinolinyl ester IUPAC Name: quinolin-8-yl 2-(4-chlorophenyl)-3,6,8-trimethylquinoline-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-3,6,8-trimethyl-cinchoninic acid 8-quinolyl ester Formula: C28H21ClN2O2 MolecularWeight: 452.93154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OC4=CC=CC5=C4N=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)Cl)C)C(=O)OC4=CC=CC5=C4N=CC=C5)C

InChI

InChI=1S/C28H21ClN2O2/c1-16-14-17(2)25-22(15-16)24(18(3)26(31-25)20-9-11-21(29)12-10-20)28(32)33-23-8-4-6-19-7-5-13-30-27(19)23/h4-15H,1-3H3