methyl (2R)-2-[4-(pentylcarbamoyl)piperidin-1-ium-1-yl]propanoate

Systemtic Name: methyl (2R)-2-[4-(pentylcarbamoyl)piperidin-1-ium-1-yl]propanoate Openeye Name: methyl (2R)-2-[4-(pentylcarbamoyl)piperidin-1-ium-1-yl]propanoate CAS Name: (2R)-2-[4-[oxo-(pentylamino)methyl]-1-piperidin-1-iumyl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[4-(pentylcarbamoyl)piperidin-1-ium-1-yl]propanoate Traditional Name: (2R)-2-[4-(amylcarbamoyl)piperidin-1-ium-1-yl]propionic acid methyl ester Formula: C15H29N2O3+ MolecularWeight: 285.40236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1CC[NH+](CC1)C(C)C(=O)OC

Isomeric SMILES

CCCCCNC(=O)C1CC[NH+](CC1)[C@H](C)C(=O)OC

InChI

InChI=1S/C15H28N2O3/c1-4-5-6-9-16-14(18)13-7-10-17(11-8-13)12(2)15(19)20-3/h12-13H,4-11H2,1-3H3,(H,16,18)/p+1/t12-/m1/s1