6-methyl-4-oxidanylidene-2-phenethyl-1H-pyrimidine-5-carboxylate

Systemtic Name: 6-methyl-4-oxidanylidene-2-phenethyl-1H-pyrimidine-5-carboxylate Openeye Name: 6-methyl-4-oxo-2-phenethyl-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-4-oxo-2-phenethyl-1H-pyrimidine-5-carboxylate IUPAC Name: 6-methyl-4-oxo-2-phenethyl-1H-pyrimidine-5-carboxylate Traditional Name: 4-keto-6-methyl-2-phenethyl-1H-pyrimidine-5-carboxylate Formula: C14H13N2O3- MolecularWeight: 257.26462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)CCC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N=C(N1)CCC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H14N2O3/c1-9-12(14(18)19)13(17)16-11(15-9)8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,18,19)(H,15,16,17)/p-1