4-butyl-N-(2-piperidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 4-butyl-N-(2-piperidin-1-ium-1-ylethyl)benzamide Openeye Name: 4-butyl-N-(2-piperidin-1-ium-1-ylethyl)benzamide CAS Name: 4-butyl-N-[2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-butyl-N-(2-piperidin-1-ium-1-ylethyl)benzamide Traditional Name: 4-butyl-N-(2-piperidin-1-ium-1-ylethyl)benzamide Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NCC[NH+]2CCCCC2

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NCC[NH+]2CCCCC2

InChI

InChI=1S/C18H28N2O/c1-2-3-7-16-8-10-17(11-9-16)18(21)19-12-15-20-13-5-4-6-14-20/h8-11H,2-7,12-15H2,1H3,(H,19,21)/p+1