6-butyl-4-(4-tert-butylphenoxy)quinoline-2-carboxylic acid

Systemtic Name: 6-butyl-4-(4-tert-butylphenoxy)quinoline-2-carboxylic acid Openeye Name: 6-butyl-4-(4-tert-butylphenoxy)quinoline-2-carboxylic acid CAS Name: 6-butyl-4-(4-tert-butylphenoxy)-2-quinolinecarboxylic acid IUPAC Name: 6-butyl-4-(4-tert-butylphenoxy)quinoline-2-carboxylic acid Traditional Name: 6-butyl-4-(4-tert-butylphenoxy)quinaldic acid Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(C=C2OC3=CC=C(C=C3)C(C)(C)C)C(=O)O

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(C=C2OC3=CC=C(C=C3)C(C)(C)C)C(=O)O

InChI

InChI=1S/C24H27NO3/c1-5-6-7-16-8-13-20-19(14-16)22(15-21(25-20)23(26)27)28-18-11-9-17(10-12-18)24(2,3)4/h8-15H,5-7H2,1-4H3,(H,26,27)