N-(1-phenethylpiperidin-1-ium-4-yl)-N-phenyl-butanamide

Systemtic Name: N-(1-phenethylpiperidin-1-ium-4-yl)-N-phenyl-butanamide Openeye Name: N-(1-phenethylpiperidin-1-ium-4-yl)-N-phenyl-butanamide CAS Name: N-(1-phenethyl-4-piperidin-1-iumyl)-N-phenylbutanamide IUPAC Name: N-(1-phenethylpiperidin-1-ium-4-yl)-N-phenylbutanamide Traditional Name: N-(1-phenethylpiperidin-1-ium-4-yl)-N-phenyl-butyramide Formula: C23H31N2O+ MolecularWeight: 351.50504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1CC[NH+](CC1)CCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N(C1CC[NH+](CC1)CCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O/c1-2-9-23(26)25(21-12-7-4-8-13-21)22-15-18-24(19-16-22)17-14-20-10-5-3-6-11-20/h3-8,10-13,22H,2,9,14-19H2,1H3/p+1