ethyl 1-[3-(2-chlorophenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(2-chlorophenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperidine-4-carboxylate CAS Name: 1-[3-(2-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-chlorophenyl)-2,4-dioxo-1H-pyrimidin-6-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(2-chlorophenyl)-2,4-diketo-1H-pyrimidin-6-yl]isonipecotic acid ethyl ester Formula: C18H20ClN3O4 MolecularWeight: 377.8221

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC(=O)N(C(=O)N2)C3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC(=O)N(C(=O)N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClN3O4/c1-2-26-17(24)12-7-9-21(10-8-12)15-11-16(23)22(18(25)20-15)14-6-4-3-5-13(14)19/h3-6,11-12H,2,7-10H2,1H3,(H,20,25)