3-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 3-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: 3-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide CAS Name: 3-oxo-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]butanamide IUPAC Name: 3-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: 3-keto-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]butyramide Formula: C17H25N2O2+ MolecularWeight: 289.3926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)NCC1=CC=C(C=C1)C[NH+]2CCCCC2

Isomeric SMILES

CC(=O)CC(=O)NCC1=CC=C(C=C1)C[NH+]2CCCCC2

InChI

InChI=1S/C17H24N2O2/c1-14(20)11-17(21)18-12-15-5-7-16(8-6-15)13-19-9-3-2-4-10-19/h5-8H,2-4,9-13H2,1H3,(H,18,21)/p+1