6-chloranyl-4-[(4-dodecylphenyl)methoxy]-8-methyl-quinoline-2-carboxylic acid

Systemtic Name: 6-chloranyl-4-[(4-dodecylphenyl)methoxy]-8-methyl-quinoline-2-carboxylic acid Openeye Name: 6-chloro-4-[(4-dodecylphenyl)methoxy]-8-methyl-quinoline-2-carboxylic acid CAS Name: 6-chloro-4-[(4-dodecylphenyl)methoxy]-8-methyl-2-quinolinecarboxylic acid IUPAC Name: 6-chloro-4-[(4-dodecylphenyl)methoxy]-8-methylquinoline-2-carboxylic acid Traditional Name: 6-chloro-4-(4-laurylbenzyl)oxy-8-methyl-quinaldic acid Formula: C30H38ClNO3 MolecularWeight: 496.08062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=CC(=NC3=C(C=C(C=C23)Cl)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=CC(=NC3=C(C=C(C=C23)Cl)C)C(=O)O

InChI

InChI=1S/C30H38ClNO3/c1-3-4-5-6-7-8-9-10-11-12-13-23-14-16-24(17-15-23)21-35-28-20-27(30(33)34)32-29-22(2)18-25(31)19-26(28)29/h14-20H,3-13,21H2,1-2H3,(H,33,34)