N-(2-ethylphenyl)-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]benzamide

Systemtic Name: N-(2-ethylphenyl)-4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]benzamide Openeye Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-(2-ethylphenyl)benzamide CAS Name: N-(2-ethylphenyl)-4-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-(2-ethylphenyl)benzamide Traditional Name: 4-[(4-benzylpiperidin-1-ium-1-yl)methyl]-N-(2-ethylphenyl)benzamide Formula: C28H33N2O+ MolecularWeight: 413.57442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C28H32N2O/c1-2-25-10-6-7-11-27(25)29-28(31)26-14-12-24(13-15-26)21-30-18-16-23(17-19-30)20-22-8-4-3-5-9-22/h3-15,23H,2,16-21H2,1H3,(H,29,31)/p+1