methyl 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]piperidine-4-carboxylate Openeye Name: methyl 1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)piperidine-4-carboxylate CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)piperidine-4-carboxylate Traditional Name: 1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)isonipecotic acid methyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

Isomeric SMILES

COC(=O)C1CCN(CC1)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)N

InChI

InChI=1S/C18H22N4O4/c1-26-17(24)13-7-9-21(10-8-13)14-15(19)22(18(25)20-16(14)23)11-12-5-3-2-4-6-12/h2-6,13H,7-11,19H2,1H3,(H,20,23,25)