4-acetamido-2-methoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide chloride

Systemtic Name: 4-acetamido-2-methoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzamide chloride Openeye Name: 4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxy-benzamide chloride CAS Name: 4-acetamido-2-methoxy-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzamide chloride IUPAC Name: 4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxybenzamide chloride Traditional Name: 4-acetamido-N-(1-benzylpiperidin-1-ium-4-yl)-2-methoxy-benzamide chloride Formula: C22H28ClN3O3 MolecularWeight: 417.92902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC.[Cl-]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3)OC.[Cl-]

InChI

InChI=1S/C22H27N3O3.ClH/c1-16(26)23-19-8-9-20(21(14-19)28-2)22(27)24-18-10-12-25(13-11-18)15-17-6-4-3-5-7-17;/h3-9,14,18H,10-13,15H2,1-2H3,(H,23,26)(H,24,27);1H