(phenylmethyl) 2-chloranyl-5-[3,4-dimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-4-fluoranyl-benzoate

Systemtic Name: (phenylmethyl) 2-chloranyl-5-[3,4-dimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-4-fluoranyl-benzoate Openeye Name: benzyl 2-chloro-5-(3,4-dimethyl-2,6-dioxo-pyrimidin-1-yl)-4-fluoro-benzoate CAS Name: 2-chloro-5-(3,4-dimethyl-2,6-dioxo-1-pyrimidinyl)-4-fluorobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-5-(3,4-dimethyl-2,6-dioxopyrimidin-1-yl)-4-fluorobenzoate Traditional Name: 2-chloro-5-(2,6-diketo-3,4-dimethyl-pyrimidin-1-yl)-4-fluoro-benzoic acid benzyl ester Formula: C20H16ClFN2O4 MolecularWeight: 402.803443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1C)C2=C(C=C(C(=C2)C(=O)OCC3=CC=CC=C3)Cl)F

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1C)C2=C(C=C(C(=C2)C(=O)OCC3=CC=CC=C3)Cl)F

InChI

InChI=1S/C20H16ClFN2O4/c1-12-8-18(25)24(20(27)23(12)2)17-9-14(15(21)10-16(17)22)19(26)28-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3