N-(5-acetamido-2-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]acetamide Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC(=O)NC2=C(C=CC(=C2)NC(=O)C)OC

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC(=O)NC2=C(C=CC(=C2)NC(=O)C)OC

InChI

InChI=1S/C17H25N3O3/c1-12-6-4-5-9-20(12)11-17(22)19-15-10-14(18-13(2)21)7-8-16(15)23-3/h7-8,10,12H,4-6,9,11H2,1-3H3,(H,18,21)(H,19,22)/p+1/t12-/m0/s1