[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2,6-bis(fluoranyl)benzoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] 2,6-bis(fluoranyl)benzoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C19H19F2NO3 MolecularWeight: 347.355866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C19H19F2NO3/c1-2-3-5-13-8-10-14(11-9-13)22-17(23)12-25-19(24)18-15(20)6-4-7-16(18)21/h4,6-11H,2-3,5,12H2,1H3,(H,22,23)