4-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 4-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 4-[2-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-oxo-ethoxy]benzoic acid CAS Name: 4-[2-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-oxoethoxy]benzoic acid IUPAC Name: 4-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethoxy]benzoic acid Traditional Name: 4-[2-[(2R,6R)-2,6-dimethylpiperidino]-2-keto-ethoxy]benzoic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)COC2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C16H21NO4/c1-11-4-3-5-12(2)17(11)15(18)10-21-14-8-6-13(7-9-14)16(19)20/h6-9,11-12H,3-5,10H2,1-2H3,(H,19,20)/t11-,12-/m1/s1