(2S)-5-methoxy-2-methyl-6-[(E)-2-nitroethenyl]-2,3-dihydro-1-benzofuran

Systemtic Name: (2S)-5-methoxy-2-methyl-6-[(E)-2-nitroethenyl]-2,3-dihydro-1-benzofuran Openeye Name: (2S)-5-methoxy-2-methyl-6-[(E)-2-nitrovinyl]-2,3-dihydrobenzofuran CAS Name: (2S)-5-methoxy-2-methyl-6-[(E)-2-nitroethenyl]-2,3-dihydrobenzofuran IUPAC Name: (2S)-5-methoxy-2-methyl-6-[(E)-2-nitroethenyl]-2,3-dihydro-1-benzofuran Traditional Name: (2S)-5-methoxy-2-methyl-6-[(E)-2-nitrovinyl]coumaran Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=C(C(=C2)OC)C=C[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CC2=C(O1)C=C(C(=C2)OC)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-8-5-10-7-11(16-2)9(3-4-13(14)15)6-12(10)17-8/h3-4,6-8H,5H2,1-2H3/b4-3+/t8-/m0/s1