4-[(2-chloranylphenoxy)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 4-[(2-chloranylphenoxy)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 4-[(2-chlorophenoxy)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 4-[(2-chlorophenoxy)methyl]-N-[4-(1-piperidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 4-[(2-chlorophenoxy)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 4-[(2-chlorophenoxy)methyl]-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C26H28ClN2O2+ MolecularWeight: 435.96572

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Cl

InChI

InChI=1S/C26H27ClN2O2/c27-24-6-2-3-7-25(24)31-19-21-8-12-22(13-9-21)26(30)28-23-14-10-20(11-15-23)18-29-16-4-1-5-17-29/h2-3,6-15H,1,4-5,16-19H2,(H,28,30)/p+1