5-[1-(2,3-dihydro-1-benzofuran-5-yl)-3-nitro-butyl]-2,3-dihydro-1-benzofuran

Systemtic Name: 5-[1-(2,3-dihydro-1-benzofuran-5-yl)-3-nitro-butyl]-2,3-dihydro-1-benzofuran Openeye Name: 5-[1-(2,3-dihydrobenzofuran-5-yl)-3-nitro-butyl]-2,3-dihydrobenzofuran CAS Name: 5-[1-(2,3-dihydrobenzofuran-5-yl)-3-nitrobutyl]-2,3-dihydrobenzofuran IUPAC Name: 5-[1-(2,3-dihydro-1-benzofuran-5-yl)-3-nitrobutyl]-2,3-dihydro-1-benzofuran Traditional Name: 5-(1-coumaran-5-yl-3-nitro-butyl)coumaran Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC2=C(C=C1)OCC2)C3=CC4=C(C=C3)OCC4)[N+](=O)[O-]

Isomeric SMILES

CC(CC(C1=CC2=C(C=C1)OCC2)C3=CC4=C(C=C3)OCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H21NO4/c1-13(21(22)23)10-18(14-2-4-19-16(11-14)6-8-24-19)15-3-5-20-17(12-15)7-9-25-20/h2-5,11-13,18H,6-10H2,1H3