4-[2-[ethyl-(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[2-[ethyl-(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-[2-(N-ethyl-3-fluoro-anilino)-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[2-(N-ethyl-3-fluoroanilino)-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[2-(N-ethyl-3-fluoroanilino)-2-oxoethyl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-[2-(N-ethyl-3-fluoro-anilino)-2-keto-ethyl]-4-phenyl-piperidine-1-carboxylic acid Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC(=CC=C1)F)C(=O)CC2(CCN(CC2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

CCN(C1=CC(=CC=C1)F)C(=O)CC2(CCN(CC2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C22H25FN2O3/c1-2-25(19-10-6-9-18(23)15-19)20(26)16-22(17-7-4-3-5-8-17)11-13-24(14-12-22)21(27)28/h3-10,15H,2,11-14,16H2,1H3,(H,27,28)