6-[(1-adamantylmethylamino)methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(1-adamantylmethylamino)methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(1-adamantylmethylamino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(1-adamantylmethylamino)methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(1-adamantylmethylamino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(1-adamantylmethylamino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC=C4C=C(C=CC4=O)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC=C4C=C(C=CC4=O)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O3/c21-17-2-1-16(20(22)23)6-15(17)10-19-11-18-7-12-3-13(8-18)5-14(4-12)9-18/h1-2,6,10,12-14,19H,3-5,7-9,11H2