octyl 2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: octyl 2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: octyl 2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-8-methyl-4-quinolinecarboxylic acid octyl ester IUPAC Name: octyl 2-(4-methoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-8-methyl-cinchoninic acid octyl ester Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=NC2=C1C=CC=C2C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H31NO3/c1-4-5-6-7-8-9-17-30-26(28)23-18-24(20-13-15-21(29-3)16-14-20)27-25-19(2)11-10-12-22(23)25/h10-16,18H,4-9,17H2,1-3H3