N-[3-(3-methylbutoxy)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(3-methylbutoxy)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(3-isopentyloxyphenyl)piperidin-1-ium-4-carboxamide CAS Name: N-[3-(3-methylbutoxy)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(3-methylbutoxy)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(3-isoamoxyphenyl)piperidin-1-ium-4-carboxamide Formula: C17H27N2O2+ MolecularWeight: 291.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=O)C2CC[NH2+]CC2

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=O)C2CC[NH2+]CC2

InChI

InChI=1S/C17H26N2O2/c1-13(2)8-11-21-16-5-3-4-15(12-16)19-17(20)14-6-9-18-10-7-14/h3-5,12-14,18H,6-11H2,1-2H3,(H,19,20)/p+1