octyl 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: octyl 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: octyl 2-(4-methoxyphenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-6-methyl-4-quinolinecarboxylic acid octyl ester IUPAC Name: octyl 2-(4-methoxyphenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)-6-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=C(C=C2)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C3=CC=C(C=C3)OC

InChI

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