[6-(4-cyanophenyl)-2-oxidanylidene-1,3-diazinan-1-yl] propanoate

Systemtic Name: [6-(4-cyanophenyl)-2-oxidanylidene-1,3-diazinan-1-yl] propanoate Openeye Name: [6-(4-cyanophenyl)-2-oxo-hexahydropyrimidin-1-yl] propanoate CAS Name: propanoic acid [6-(4-cyanophenyl)-2-oxo-1,3-diazinan-1-yl] ester IUPAC Name: [6-(4-cyanophenyl)-2-oxo-1,3-diazinan-1-yl] propanoate Traditional Name: propionic acid [6-(4-cyanophenyl)-2-keto-hexahydropyrimidin-1-yl] ester Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON1C(CCNC1=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC(=O)ON1C(CCNC1=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H15N3O3/c1-2-13(18)20-17-12(7-8-16-14(17)19)11-5-3-10(9-15)4-6-11/h3-6,12H,2,7-8H2,1H3,(H,16,19)