methyl 1-[2-[4-(2-cyanoethanoylamino)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[4-(2-cyanoethanoylamino)phenyl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[4-[(2-cyanoacetyl)amino]benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4-[(2-cyano-1-oxoethyl)amino]phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-[(2-cyanoacetyl)amino]benzoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-[(2-cyanoacetyl)amino]benzoyl]oxyacetyl]isonipecotic acid methyl ester Formula: C19H21N3O6 MolecularWeight: 387.38654

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CC#N

InChI

InChI=1S/C19H21N3O6/c1-27-18(25)14-7-10-22(11-8-14)17(24)12-28-19(26)13-2-4-15(5-3-13)21-16(23)6-9-20/h2-5,14H,6-8,10-12H2,1H3,(H,21,23)