[1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2,5-dimethylbenzoate

Systemtic Name: [1-[(3-fluorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2,5-dimethylbenzoate Openeye Name: [2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl] 2,5-dimethylbenzoate CAS Name: 2,5-dimethylbenzoic acid [1-(3-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-fluoroanilino)-1-oxopropan-2-yl] 2,5-dimethylbenzoate Traditional Name: 2,5-dimethylbenzoic acid [2-(3-fluoroanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H18FNO3 MolecularWeight: 315.338823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)OC(C)C(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)OC(C)C(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C18H18FNO3/c1-11-7-8-12(2)16(9-11)18(22)23-13(3)17(21)20-15-6-4-5-14(19)10-15/h4-10,13H,1-3H3,(H,20,21)