N-phenethyl-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-phenethyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-phenethyl-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-phenethyl-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-phenethyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-phenethyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C21H27N2O+ MolecularWeight: 323.45188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O/c24-21(22-14-13-18-7-3-1-4-8-18)20-11-9-19(10-12-20)17-23-15-5-2-6-16-23/h1,3-4,7-12H,2,5-6,13-17H2,(H,22,24)/p+1