(4-methoxy-3,5-dimethyl-phenyl)-[(3S)-1-propylpiperidin-1-ium-3-yl]methanone

Systemtic Name: (4-methoxy-3,5-dimethyl-phenyl)-[(3S)-1-propylpiperidin-1-ium-3-yl]methanone Openeye Name: (4-methoxy-3,5-dimethyl-phenyl)-[(3S)-1-propylpiperidin-1-ium-3-yl]methanone CAS Name: (4-methoxy-3,5-dimethylphenyl)-[(3S)-1-propyl-3-piperidin-1-iumyl]methanone IUPAC Name: (4-methoxy-3,5-dimethylphenyl)-[(3S)-1-propylpiperidin-1-ium-3-yl]methanone Traditional Name: (4-methoxy-3,5-dimethyl-phenyl)-[(3S)-1-propylpiperidin-1-ium-3-yl]methanone Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCC(C1)C(=O)C2=CC(=C(C(=C2)C)OC)C

Isomeric SMILES

CCC[NH+]1CCC[C@@H](C1)C(=O)C2=CC(=C(C(=C2)C)OC)C

InChI

InChI=1S/C18H27NO2/c1-5-8-19-9-6-7-15(12-19)17(20)16-10-13(2)18(21-4)14(3)11-16/h10-11,15H,5-9,12H2,1-4H3/p+1/t15-/m0/s1