N-(4-methyl-2-oxidanyl-phenyl)-2-[3-[2-[(4-methyl-2-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]imidazol-3-ium-1-yl]ethanamide

Systemtic Name: N-(4-methyl-2-oxidanyl-phenyl)-2-[3-[2-[(4-methyl-2-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]imidazol-3-ium-1-yl]ethanamide Openeye Name: 2-[3-[2-(2-hydroxy-4-methyl-anilino)-2-oxo-ethyl]imidazol-3-ium-1-yl]-N-(2-hydroxy-4-methyl-phenyl)acetamide CAS Name: 2-[3-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]-1-imidazol-3-iumyl]-N-(2-hydroxy-4-methylphenyl)acetamide IUPAC Name: 2-[3-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]imidazol-3-ium-1-yl]-N-(2-hydroxy-4-methylphenyl)acetamide Traditional Name: 2-[3-[2-(2-hydroxy-4-methyl-anilino)-2-keto-ethyl]imidazol-3-ium-1-yl]-N-(2-hydroxy-4-methyl-phenyl)acetamide Formula: C21H23N4O4+ MolecularWeight: 395.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C=C[N+](=C2)CC(=O)NC3=C(C=C(C=C3)C)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C=C[N+](=C2)CC(=O)NC3=C(C=C(C=C3)C)O)O

InChI

InChI=1S/C21H22N4O4/c1-14-3-5-16(18(26)9-14)22-20(28)11-24-7-8-25(13-24)12-21(29)23-17-6-4-15(2)10-19(17)27/h3-10,13H,11-12H2,1-2H3,(H3-,22,23,26,27,28,29)/p+1