methyl 4-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propoxy]benzoate

Systemtic Name: methyl 4-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propoxy]benzoate Openeye Name: methyl 4-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propoxy]benzoate CAS Name: 4-[3-[(3R)-3-methyl-1-piperidin-1-iumyl]propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propoxy]benzoate Traditional Name: 4-[3-[(3R)-3-methylpiperidin-1-ium-1-yl]propoxy]benzoic acid methyl ester Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCOC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CCCOC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H25NO3/c1-14-5-3-10-18(13-14)11-4-12-21-16-8-6-15(7-9-16)17(19)20-2/h6-9,14H,3-5,10-13H2,1-2H3/p+1/t14-/m1/s1