N-[3-(2-hydroxyethyl)-6-(2-nitroimidazol-1-yl)-5-oxidanyl-hexyl]-7-methoxy-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[3-(2-hydroxyethyl)-6-(2-nitroimidazol-1-yl)-5-oxidanyl-hexyl]-7-methoxy-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[5-hydroxy-3-(2-hydroxyethyl)-6-(2-nitroimidazol-1-yl)hexyl]-7-methoxy-2-oxo-chromene-3-carboxamide CAS Name: N-[5-hydroxy-3-(2-hydroxyethyl)-6-(2-nitro-1-imidazolyl)hexyl]-7-methoxy-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[5-hydroxy-3-(2-hydroxyethyl)-6-(2-nitroimidazol-1-yl)hexyl]-7-methoxy-2-oxochromene-3-carboxamide Traditional Name: N-[5-hydroxy-3-(2-hydroxyethyl)-6-(2-nitroimidazol-1-yl)hexyl]-2-keto-7-methoxy-chromene-3-carboxamide Formula: C22H26N4O8 MolecularWeight: 474.46384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCC(CCO)CC(CN3C=CN=C3[N+](=O)[O-])O

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCC(CCO)CC(CN3C=CN=C3[N+](=O)[O-])O

InChI

InChI=1S/C22H26N4O8/c1-33-17-3-2-15-11-18(21(30)34-19(15)12-17)20(29)23-6-4-14(5-9-27)10-16(28)13-25-8-7-24-22(25)26(31)32/h2-3,7-8,11-12,14,16,27-28H,4-6,9-10,13H2,1H3,(H,23,29)