methyl 2-(2-methylpropanoyloxymethyl)-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-(2-methylpropanoyloxymethyl)-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-(2-methylpropanoyloxymethyl)-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[(2-methyl-1-oxopropoxy)methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylpropanoyloxymethyl)-4-phenylquinoline-3-carboxylate Traditional Name: 2-(isobutyryloxymethyl)-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC1=NC2=CC=CC=C2C(=C1C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)OCC1=NC2=CC=CC=C2C(=C1C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO4/c1-14(2)21(24)27-13-18-20(22(25)26-3)19(15-9-5-4-6-10-15)16-11-7-8-12-17(16)23-18/h4-12,14H,13H2,1-3H3