3-(4-imidazol-1-ylphenoxy)-4,5-bis(oxidanyl)-N-(2-oxidanylidenepiperidin-3-yl)cyclohexene-1-carboxamide

Systemtic Name: 3-(4-imidazol-1-ylphenoxy)-4,5-bis(oxidanyl)-N-(2-oxidanylidenepiperidin-3-yl)cyclohexene-1-carboxamide Openeye Name: 4,5-dihydroxy-3-(4-imidazol-1-ylphenoxy)-N-(2-oxo-3-piperidyl)cyclohexene-1-carboxamide CAS Name: 4,5-dihydroxy-3-[4-(1-imidazolyl)phenoxy]-N-(2-oxo-3-piperidinyl)-1-cyclohexenecarboxamide IUPAC Name: 4,5-dihydroxy-3-(4-imidazol-1-ylphenoxy)-N-(2-oxopiperidin-3-yl)cyclohexene-1-carboxamide Traditional Name: 4,5-dihydroxy-3-(4-imidazol-1-ylphenoxy)-N-(2-keto-3-piperidyl)cyclohexene-1-carboxamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)NC(=O)C2=CC(C(C(C2)O)O)OC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1CC(C(=O)NC1)NC(=O)C2=CC(C(C(C2)O)O)OC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H24N4O5/c26-17-10-13(20(28)24-16-2-1-7-23-21(16)29)11-18(19(17)27)30-15-5-3-14(4-6-15)25-9-8-22-12-25/h3-6,8-9,11-12,16-19,26-27H,1-2,7,10H2,(H,23,29)(H,24,28)