3-(3-nitro-4-octoxy-phenyl)-2-oxidanyl-2H-furan-5-one

Systemtic Name: 3-(3-nitro-4-octoxy-phenyl)-2-oxidanyl-2H-furan-5-one Openeye Name: 2-hydroxy-3-(3-nitro-4-octoxy-phenyl)-2H-furan-5-one CAS Name: 2-hydroxy-3-(3-nitro-4-octoxyphenyl)-2H-furan-5-one IUPAC Name: 2-hydroxy-3-(3-nitro-4-octoxyphenyl)-2H-furan-5-one Traditional Name: 2-hydroxy-3-(3-nitro-4-octoxy-phenyl)-2H-furan-5-one Formula: C18H23NO6 MolecularWeight: 349.37832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=CC(=O)OC2O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=CC(=O)OC2O)[N+](=O)[O-]

InChI

InChI=1S/C18H23NO6/c1-2-3-4-5-6-7-10-24-16-9-8-13(11-15(16)19(22)23)14-12-17(20)25-18(14)21/h8-9,11-12,18,21H,2-7,10H2,1H3