(1-phenylpyrazol-4-yl)methyl 3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]propanoate

Systemtic Name: (1-phenylpyrazol-4-yl)methyl 3-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]propanoate Openeye Name: (1-phenylpyrazol-4-yl)methyl 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanoate CAS Name: 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanoic acid (1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenylpyrazol-4-yl)methyl 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(2,4-diketo-6-methyl-1H-pyrimidin-5-yl)propionic acid (1-phenylpyrazol-4-yl)methyl ester Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)CCC(=O)OCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)CCC(=O)OCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O4/c1-12-15(17(24)21-18(25)20-12)7-8-16(23)26-11-13-9-19-22(10-13)14-5-3-2-4-6-14/h2-6,9-10H,7-8,11H2,1H3,(H2,20,21,24,25)