4-ethyl-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O/c1-2-17-6-10-19(11-7-17)21(24)22-20-12-8-18(9-13-20)16-23-14-4-3-5-15-23/h6-13H,2-5,14-16H2,1H3,(H,22,24)/p+1