6-butyl-4-(8-methylnonoxy)quinoline-2-carboxylic acid

Systemtic Name: 6-butyl-4-(8-methylnonoxy)quinoline-2-carboxylic acid Openeye Name: 6-butyl-4-(8-methylnonoxy)quinoline-2-carboxylic acid CAS Name: 6-butyl-4-(8-methylnonoxy)-2-quinolinecarboxylic acid IUPAC Name: 6-butyl-4-(8-methylnonoxy)quinoline-2-carboxylic acid Traditional Name: 6-butyl-4-(8-methylnonoxy)quinaldic acid Formula: C24H35NO3 MolecularWeight: 385.5396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(C=C2OCCCCCCCC(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(C=C2OCCCCCCCC(C)C)C(=O)O

InChI

InChI=1S/C24H35NO3/c1-4-5-12-19-13-14-21-20(16-19)23(17-22(25-21)24(26)27)28-15-10-8-6-7-9-11-18(2)3/h13-14,16-18H,4-12,15H2,1-3H3,(H,26,27)