N-(3-ethoxyphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide

Systemtic Name: N-(3-ethoxyphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Openeye Name: N-(3-ethoxyphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide CAS Name: N-(3-ethoxyphenyl)-4-(1-piperidin-1-iumylmethyl)benzamide IUPAC Name: N-(3-ethoxyphenyl)-4-(piperidin-1-ium-1-ylmethyl)benzamide Traditional Name: N-m-phenetyl-4-(piperidin-1-ium-1-ylmethyl)benzamide Formula: C21H27N2O2+ MolecularWeight: 339.45128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H26N2O2/c1-2-25-20-8-6-7-19(15-20)22-21(24)18-11-9-17(10-12-18)16-23-13-4-3-5-14-23/h6-12,15H,2-5,13-14,16H2,1H3,(H,22,24)/p+1