methyl 4-(phenylmethyl)-1-pyridin-3-ylcarbonyl-piperazine-2-carboxylate

Systemtic Name: methyl 4-(phenylmethyl)-1-pyridin-3-ylcarbonyl-piperazine-2-carboxylate Openeye Name: methyl 4-benzyl-1-(pyridine-3-carbonyl)piperazine-2-carboxylate CAS Name: 1-[oxo(3-pyridinyl)methyl]-4-(phenylmethyl)-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-benzyl-1-(pyridine-3-carbonyl)piperazine-2-carboxylate Traditional Name: 4-benzyl-1-nicotinoyl-piperazine-2-carboxylic acid methyl ester Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1C(=O)C2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CN(CCN1C(=O)C2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O3/c1-25-19(24)17-14-21(13-15-6-3-2-4-7-15)10-11-22(17)18(23)16-8-5-9-20-12-16/h2-9,12,17H,10-11,13-14H2,1H3