N-(3-acetamido-2-oxidanyl-phenyl)-2-(1,4-dimethylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-acetamido-2-oxidanyl-phenyl)-2-(1,4-dimethylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(3-acetamido-2-hydroxy-phenyl)-2-(1,4-dimethylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(3-acetamido-2-hydroxyphenyl)-2-(1,4-dimethyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(3-acetamido-2-hydroxyphenyl)-2-(1,4-dimethylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(3-acetamido-2-hydroxy-phenyl)-2-(1,4-dimethylpiperazin-1-ium-1-yl)acetamide Formula: C16H25N4O3+ MolecularWeight: 321.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=CC=C1)NC(=O)C[N+]2(CCN(CC2)C)C)O

Isomeric SMILES

CC(=O)NC1=C(C(=CC=C1)NC(=O)C[N+]2(CCN(CC2)C)C)O

InChI

InChI=1S/C16H24N4O3/c1-12(21)17-13-5-4-6-14(16(13)23)18-15(22)11-20(3)9-7-19(2)8-10-20/h4-6H,7-11H2,1-3H3,(H2-,17,18,21,22,23)/p+1