2-(4-butylphenyl)-6,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-butylphenyl)-6,8-dimethyl-quinoline-4-carboxylate Openeye Name: 2-(4-butylphenyl)-6,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(4-butylphenyl)-6,8-dimethyl-4-quinolinecarboxylate IUPAC Name: 2-(4-butylphenyl)-6,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(4-butylphenyl)-6,8-dimethyl-cinchoninate Formula: C22H22NO2- MolecularWeight: 332.41558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)[O-])C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3C(=C2)C(=O)[O-])C)C

InChI

InChI=1S/C22H23NO2/c1-4-5-6-16-7-9-17(10-8-16)20-13-19(22(24)25)18-12-14(2)11-15(3)21(18)23-20/h7-13H,4-6H2,1-3H3,(H,24,25)/p-1