[2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] 2-fluoranyl-4-methoxy-benzoate

Systemtic Name: [2-[3-[methyl(phenyl)amino]propylamino]-2-oxidanylidene-ethyl] 2-fluoranyl-4-methoxy-benzoate Openeye Name: [2-[3-(N-methylanilino)propylamino]-2-oxo-ethyl] 2-fluoro-4-methoxy-benzoate CAS Name: 2-fluoro-4-methoxybenzoic acid [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] ester IUPAC Name: [2-[3-(N-methylanilino)propylamino]-2-oxoethyl] 2-fluoro-4-methoxybenzoate Traditional Name: 2-fluoro-4-methoxy-benzoic acid [2-keto-2-[3-(N-methylanilino)propylamino]ethyl] ester Formula: C20H23FN2O4 MolecularWeight: 374.406023

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)COC(=O)C1=C(C=C(C=C1)OC)F)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)COC(=O)C1=C(C=C(C=C1)OC)F)C2=CC=CC=C2

InChI

InChI=1S/C20H23FN2O4/c1-23(15-7-4-3-5-8-15)12-6-11-22-19(24)14-27-20(25)17-10-9-16(26-2)13-18(17)21/h3-5,7-10,13H,6,11-12,14H2,1-2H3,(H,22,24)