(6-chloranylimidazo[1,2-a]pyridin-2-yl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (6-chloranylimidazo[1,2-a]pyridin-2-yl)methyl 1-(2-methylphenyl)carbonylpiperidine-4-carboxylate Openeye Name: (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid (6-chloro-2-imidazo[1,2-a]pyridinyl)methyl ester IUPAC Name: (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl 1-(2-methylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-o-toluoylisonipecotic acid (6-chloroimidazo[1,2-a]pyridin-2-yl)methyl ester Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC3=CN4C=C(C=CC4=N3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)OCC3=CN4C=C(C=CC4=N3)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-15-4-2-3-5-19(15)21(27)25-10-8-16(9-11-25)22(28)29-14-18-13-26-12-17(23)6-7-20(26)24-18/h2-7,12-13,16H,8-11,14H2,1H3