[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 3-fluoranyl-4-methoxy-benzoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 3-fluoro-4-methoxy-benzoate CAS Name: 3-fluoro-4-methoxybenzoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 3-fluoro-4-methoxybenzoate Traditional Name: 3-fluoro-4-methoxy-benzoic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C18H18FNO4 MolecularWeight: 331.338223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC(=C(C=C2)OC)F

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C18H18FNO4/c1-12-5-3-4-6-14(12)10-20-17(21)11-24-18(22)13-7-8-16(23-2)15(19)9-13/h3-9H,10-11H2,1-2H3,(H,20,21)