N-(5-acetamido-2-methoxy-phenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c1-17(27)24-20-8-9-22(29-2)21(15-20)25-23(28)16-26-12-10-19(11-13-26)14-18-6-4-3-5-7-18/h3-9,15,19H,10-14,16H2,1-2H3,(H,24,27)(H,25,28)/p+1