(4-methoxyphenyl) 2-ethyl-3,6-dimethyl-quinoline-4-carboxylate

Systemtic Name: (4-methoxyphenyl) 2-ethyl-3,6-dimethyl-quinoline-4-carboxylate Openeye Name: (4-methoxyphenyl) 2-ethyl-3,6-dimethyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3,6-dimethyl-4-quinolinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 2-ethyl-3,6-dimethylquinoline-4-carboxylate Traditional Name: 2-ethyl-3,6-dimethyl-cinchoninic acid (4-methoxyphenyl) ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=C(C=CC2=N1)C)C(=O)OC3=CC=C(C=C3)OC)C

Isomeric SMILES

CCC1=C(C(=C2C=C(C=CC2=N1)C)C(=O)OC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H21NO3/c1-5-18-14(3)20(17-12-13(2)6-11-19(17)22-18)21(23)25-16-9-7-15(24-4)8-10-16/h6-12H,5H2,1-4H3