methyl 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl-phenethyl-carbamoyl]benzoate

Systemtic Name: methyl 2-[[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]methyl-phenethyl-carbamoyl]benzoate Openeye Name: methyl 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methyl-phenethyl-carbamoyl]benzoate CAS Name: 2-[[(2,4-dioxo-1H-pyrimidin-5-yl)methyl-phenethylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(2,4-dioxo-1H-pyrimidin-5-yl)methyl-phenethylcarbamoyl]benzoate Traditional Name: 2-[(2,4-diketo-1H-pyrimidin-5-yl)methyl-phenethyl-carbamoyl]benzoic acid methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)N(CCC2=CC=CC=C2)CC3=CNC(=O)NC3=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N(CCC2=CC=CC=C2)CC3=CNC(=O)NC3=O

InChI

InChI=1S/C22H21N3O5/c1-30-21(28)18-10-6-5-9-17(18)20(27)25(12-11-15-7-3-2-4-8-15)14-16-13-23-22(29)24-19(16)26/h2-10,13H,11-12,14H2,1H3,(H2,23,24,26,29)