4-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propoxy]benzoic acid

Systemtic Name: 4-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propoxy]benzoic acid Openeye Name: 4-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propoxy]benzoic acid CAS Name: 4-[3-[(2S,6S)-2,6-dimethyl-4-morpholinyl]propoxy]benzoic acid IUPAC Name: 4-[3-[(2S,6S)-2,6-dimethylmorpholin-4-yl]propoxy]benzoic acid Traditional Name: 4-[3-[(2S,6S)-2,6-dimethylmorpholino]propoxy]benzoic acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)CCCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)CCCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H23NO4/c1-12-10-17(11-13(2)21-12)8-3-9-20-15-6-4-14(5-7-15)16(18)19/h4-7,12-13H,3,8-11H2,1-2H3,(H,18,19)/t12-,13-/m0/s1