2-[[4-(1-adamantylcarbonylamino)phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[4-(1-adamantylcarbonylamino)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[4-(adamantane-1-carbonylamino)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[4-[[1-adamantyl(oxo)methyl]amino]phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[4-(adamantane-1-carbonylamino)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[4-(adamantane-1-carbonylamino)phenyl]iminomethyl]-4-nitro-phenolate Formula: C24H24N3O4- MolecularWeight: 418.46506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)N=CC5=C(C=CC(=C5)[N+](=O)[O-])[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)N=CC5=C(C=CC(=C5)[N+](=O)[O-])[O-]

InChI

InChI=1S/C24H25N3O4/c28-22-6-5-21(27(30)31)10-18(22)14-25-19-1-3-20(4-2-19)26-23(29)24-11-15-7-16(12-24)9-17(8-15)13-24/h1-6,10,14-17,28H,7-9,11-13H2,(H,26,29)/p-1