4-[(4-dodecylphenyl)methoxy]-3,8-dimethyl-quinoline-2-carboxylic acid

Systemtic Name: 4-[(4-dodecylphenyl)methoxy]-3,8-dimethyl-quinoline-2-carboxylic acid Openeye Name: 4-[(4-dodecylphenyl)methoxy]-3,8-dimethyl-quinoline-2-carboxylic acid CAS Name: 4-[(4-dodecylphenyl)methoxy]-3,8-dimethyl-2-quinolinecarboxylic acid IUPAC Name: 4-[(4-dodecylphenyl)methoxy]-3,8-dimethylquinoline-2-carboxylic acid Traditional Name: 4-(4-laurylbenzyl)oxy-3,8-dimethyl-quinaldic acid Formula: C31H41NO3 MolecularWeight: 475.66214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=C(C(=NC3=C2C=CC=C3C)C(=O)O)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)COC2=C(C(=NC3=C2C=CC=C3C)C(=O)O)C

InChI

InChI=1S/C31H41NO3/c1-4-5-6-7-8-9-10-11-12-13-16-25-18-20-26(21-19-25)22-35-30-24(3)29(31(33)34)32-28-23(2)15-14-17-27(28)30/h14-15,17-21H,4-13,16,22H2,1-3H3,(H,33,34)