N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-ethoxy-3-methoxy-benzamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-ethoxy-3-methoxy-benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-ethoxy-3-methoxy-benzamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-4-ethoxy-3-methoxybenzamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-4-ethoxy-3-methoxybenzamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-4-ethoxy-3-methoxy-benzamide Formula: C22H28ClN2O3+ MolecularWeight: 403.92232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H27ClN2O3/c1-3-28-20-9-6-17(14-21(20)27-2)22(26)24-19-10-12-25(13-11-19)15-16-4-7-18(23)8-5-16/h4-9,14,19H,3,10-13,15H2,1-2H3,(H,24,26)/p+1