3-nitro-6-(8-oxidanyloctoxy)chromen-2-one

Systemtic Name: 3-nitro-6-(8-oxidanyloctoxy)chromen-2-one Openeye Name: 6-(8-hydroxyoctoxy)-3-nitro-chromen-2-one CAS Name: 6-(8-hydroxyoctoxy)-3-nitro-1-benzopyran-2-one IUPAC Name: 6-(8-hydroxyoctoxy)-3-nitrochromen-2-one Traditional Name: 6-(8-hydroxyoctoxy)-3-nitro-coumarin Formula: C17H21NO6 MolecularWeight: 335.35174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OCCCCCCCCO)C=C(C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1OCCCCCCCCO)C=C(C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C17H21NO6/c19-9-5-3-1-2-4-6-10-23-14-7-8-16-13(11-14)12-15(18(21)22)17(20)24-16/h7-8,11-12,19H,1-6,9-10H2