[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-ethanoyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 1-ethanoyl-4-phenyl-piperidine-4-carboxylate Openeye Name: [2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl] 1-acetyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-acetyl-4-phenyl-4-piperidinecarboxylic acid [2-(3-fluoro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-methylanilino)-2-oxoethyl] 1-acetyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-acetyl-4-phenyl-isonipecotic acid [2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C23H25FN2O4 MolecularWeight: 412.454003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2(CCN(CC2)C(=O)C)C3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2(CCN(CC2)C(=O)C)C3=CC=CC=C3)F

InChI

InChI=1S/C23H25FN2O4/c1-16-8-9-19(14-20(16)24)25-21(28)15-30-22(29)23(18-6-4-3-5-7-18)10-12-26(13-11-23)17(2)27/h3-9,14H,10-13,15H2,1-2H3,(H,25,28)