pentyl 3,6,8-trimethyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: pentyl 3,6,8-trimethyl-2-phenyl-quinoline-4-carboxylate Openeye Name: pentyl 3,6,8-trimethyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3,6,8-trimethyl-2-phenyl-4-quinolinecarboxylic acid pentyl ester IUPAC Name: pentyl 3,6,8-trimethyl-2-phenylquinoline-4-carboxylate Traditional Name: 3,6,8-trimethyl-2-phenyl-cinchoninic acid amyl ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C(=NC2=C(C=C(C=C12)C)C)C3=CC=CC=C3)C

Isomeric SMILES

CCCCCOC(=O)C1=C(C(=NC2=C(C=C(C=C12)C)C)C3=CC=CC=C3)C

InChI

InChI=1S/C24H27NO2/c1-5-6-10-13-27-24(26)21-18(4)23(19-11-8-7-9-12-19)25-22-17(3)14-16(2)15-20(21)22/h7-9,11-12,14-15H,5-6,10,13H2,1-4H3