N-(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)-3-(2-bromanyl-5-fluoranyl-phenoxy)-4,5-bis(oxidanyl)cyclohexene-1-carboxamide

Systemtic Name: N-(1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl)-3-(2-bromanyl-5-fluoranyl-phenoxy)-4,5-bis(oxidanyl)cyclohexene-1-carboxamide Openeye Name: 3-(2-bromo-5-fluoro-phenoxy)-N-(1-carbamoyl-3-methyl-butyl)-4,5-dihydroxy-cyclohexene-1-carboxamide CAS Name: N-(1-amino-4-methyl-1-oxopentan-2-yl)-3-(2-bromo-5-fluorophenoxy)-4,5-dihydroxy-1-cyclohexenecarboxamide IUPAC Name: N-(1-amino-4-methyl-1-oxopentan-2-yl)-3-(2-bromo-5-fluorophenoxy)-4,5-dihydroxycyclohexene-1-carboxamide Traditional Name: 3-(2-bromo-5-fluoro-phenoxy)-N-(1-carbamoyl-3-methyl-butyl)-4,5-dihydroxy-cyclohexene-1-carboxamide Formula: C19H24BrFN2O5 MolecularWeight: 459.306663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC(=O)C1=CC(C(C(C1)O)O)OC2=C(C=CC(=C2)F)Br

Isomeric SMILES

CC(C)CC(C(=O)N)NC(=O)C1=CC(C(C(C1)O)O)OC2=C(C=CC(=C2)F)Br

InChI

InChI=1S/C19H24BrFN2O5/c1-9(2)5-13(18(22)26)23-19(27)10-6-14(24)17(25)16(7-10)28-15-8-11(21)3-4-12(15)20/h3-4,7-9,13-14,16-17,24-25H,5-6H2,1-2H3,(H2,22,26)(H,23,27)