4-(4-fluorophenyl)-1-methyl-6-oxidanyl-2-oxidanylidene-3-propan-2-yl-piperidine-3-carboxylic acid

Systemtic Name: 4-(4-fluorophenyl)-1-methyl-6-oxidanyl-2-oxidanylidene-3-propan-2-yl-piperidine-3-carboxylic acid Openeye Name: 4-(4-fluorophenyl)-6-hydroxy-3-isopropyl-1-methyl-2-oxo-piperidine-3-carboxylic acid CAS Name: 4-(4-fluorophenyl)-6-hydroxy-1-methyl-2-oxo-3-propan-2-yl-3-piperidinecarboxylic acid IUPAC Name: 4-(4-fluorophenyl)-6-hydroxy-1-methyl-2-oxo-3-propan-2-ylpiperidine-3-carboxylic acid Traditional Name: 4-(4-fluorophenyl)-6-hydroxy-3-isopropyl-2-keto-1-methyl-nipecotic acid Formula: C16H20FNO4 MolecularWeight: 309.332703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(CC(N(C1=O)C)O)C2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

CC(C)C1(C(CC(N(C1=O)C)O)C2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C16H20FNO4/c1-9(2)16(15(21)22)12(8-13(19)18(3)14(16)20)10-4-6-11(17)7-5-10/h4-7,9,12-13,19H,8H2,1-3H3,(H,21,22)