5-(4,5-dimethoxy-2-nitro-phenyl)oxolan-2-one

Systemtic Name: 5-(4,5-dimethoxy-2-nitro-phenyl)oxolan-2-one Openeye Name: 5-(4,5-dimethoxy-2-nitro-phenyl)tetrahydrofuran-2-one CAS Name: 5-(4,5-dimethoxy-2-nitrophenyl)-2-oxolanone IUPAC Name: 5-(4,5-dimethoxy-2-nitrophenyl)oxolan-2-one Traditional Name: 5-(4,5-dimethoxy-2-nitro-phenyl)tetrahydrofuran-2-one Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2CCC(=O)O2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2CCC(=O)O2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H13NO6/c1-17-10-5-7(9-3-4-12(14)19-9)8(13(15)16)6-11(10)18-2/h5-6,9H,3-4H2,1-2H3