2-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]propane-1,3-diol

Systemtic Name: 2-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]propane-1,3-diol Openeye Name: 2-[(2-nitro-3-phenyl-benzofuran-7-yl)methyl]propane-1,3-diol CAS Name: 2-[(2-nitro-3-phenyl-7-benzofuranyl)methyl]propane-1,3-diol IUPAC Name: 2-[(2-nitro-3-phenyl-1-benzofuran-7-yl)methyl]propane-1,3-diol Traditional Name: 2-[(2-nitro-3-phenyl-benzofuran-7-yl)methyl]propane-1,3-diol Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C2C=CC=C3CC(CO)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C2C=CC=C3CC(CO)CO)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO5/c20-10-12(11-21)9-14-7-4-8-15-16(13-5-2-1-3-6-13)18(19(22)23)24-17(14)15/h1-8,12,20-21H,9-11H2