(4-methoxycarbonylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid (4-carbomethoxybenzyl) ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H21NO4/c1-4-18-14(2)20(17-7-5-6-8-19(17)23-18)22(25)27-13-15-9-11-16(12-10-15)21(24)26-3/h5-12H,4,13H2,1-3H3