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N-[4-(1-adamantyl)phenyl]-5-nitro-1-benzofuran-3-carboxamide

N-[4-(1-adamantyl)phenyl]-5-nitro-1-benzofuran-3-carboxamide

Systemtic Name:N-[4-(1-adamantyl)phenyl]-5-nitro-1-benzofuran-3-carboxamide
Openeye Name:N-[4-(1-adamantyl)phenyl]-5-nitro-benzofuran-3-carboxamide
CAS Name:N-[4-(1-adamantyl)phenyl]-5-nitro-3-benzofurancarboxamide
IUPAC Name:N-[4-(1-adamantyl)phenyl]-5-nitro-1-benzofuran-3-carboxamide
Traditional Name:N-[4-(1-adamantyl)phenyl]-5-nitro-benzofuran-3-carboxamide
Formula: C25H24N2O4
MolecularWeight: 416.46906
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=COC6=C5C=C(C=C6)[N+](=O)[O-]


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)C5=COC6=C5C=C(C=C6)[N+](=O)[O-]


InChI

InChI=1S/C25H24N2O4/c28-24(22-14-31-23-6-5-20(27(29)30)10-21(22)23)26-19-3-1-18(2-4-19)25-11-15-7-16(12-25)9-17(8-15)13-25/h1-6,10,14-17H,7-9,11-13H2,(H,26,28)


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