N-(4-acetamido-3-chloranyl-5-oxidanyl-phenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)ethanamide

Systemtic Name: N-(4-acetamido-3-chloranyl-5-oxidanyl-phenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)ethanamide Openeye Name: N-(4-acetamido-3-chloro-5-hydroxy-phenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)acetamide CAS Name: N-(4-acetamido-3-chloro-5-hydroxyphenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)acetamide IUPAC Name: N-(4-acetamido-3-chloro-5-hydroxyphenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)acetamide Traditional Name: N-(4-acetamido-3-chloro-5-hydroxy-phenyl)-2-(3-methyl-1H-imidazol-3-ium-2-yl)acetamide Formula: C14H16ClN4O3+ MolecularWeight: 323.75484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1Cl)NC(=O)CC2=[N+](C=CN2)C)O

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1Cl)NC(=O)CC2=[N+](C=CN2)C)O

InChI

InChI=1S/C14H15ClN4O3/c1-8(20)17-14-10(15)5-9(6-11(14)21)18-13(22)7-12-16-3-4-19(12)2/h3-6H,7H2,1-2H3,(H3,17,18,20,21,22)/p+1