methyl 1-[2-[(2-chloranylpyridin-3-yl)-phenyl-methoxy]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(2-chloranylpyridin-3-yl)-phenyl-methoxy]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(2-chloro-3-pyridyl)-phenyl-methoxy]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-chloro-3-pyridinyl)-phenylmethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(2-chloropyridin-3-yl)-phenylmethoxy]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-chloro-3-pyridyl)-phenyl-methoxy]acetyl]isonipecotic acid methyl ester Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(C2=CC=CC=C2)C3=C(N=CC=C3)Cl

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(C2=CC=CC=C2)C3=C(N=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-27-21(26)16-9-12-24(13-10-16)18(25)14-28-19(15-6-3-2-4-7-15)17-8-5-11-23-20(17)22/h2-8,11,16,19H,9-10,12-14H2,1H3