[1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-fluoranylbenzoate

Systemtic Name: [1-[(2,5-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-fluoranylbenzoate Openeye Name: [2-(2,5-dimethylanilino)-1-methyl-2-oxo-ethyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [1-(2,5-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,5-dimethylanilino)-1-oxopropan-2-yl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [2-(2,5-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H18FNO3 MolecularWeight: 315.338823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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