(2,5-dimethoxyphenyl)methyl 2-cyclopropylquinoline-4-carboxylate

Systemtic Name: (2,5-dimethoxyphenyl)methyl 2-cyclopropylquinoline-4-carboxylate Openeye Name: (2,5-dimethoxyphenyl)methyl 2-cyclopropylquinoline-4-carboxylate CAS Name: 2-cyclopropyl-4-quinolinecarboxylic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl 2-cyclopropylquinoline-4-carboxylate Traditional Name: 2-cyclopropylcinchoninic acid (2,5-dimethoxybenzyl) ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C22H21NO4/c1-25-16-9-10-21(26-2)15(11-16)13-27-22(24)18-12-20(14-7-8-14)23-19-6-4-3-5-17(18)19/h3-6,9-12,14H,7-8,13H2,1-2H3