(6E)-6-[(1-adamantylamino)methylidene]-4-methyl-2-nitro-cyclohexa-2,4-dien-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC23CC4CC(C2)CC(C4)C3)C(=O)C(=C1)[N+](=O)[O-]

Isomeric SMILES

CC1=C/C(=C\NC23CC4CC(C2)CC(C4)C3)/C(=O)C(=C1)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O3/c1-11-2-15(17(21)16(3-11)20(22)23)10-19-18-7-12-4-13(8-18)6-14(5-12)9-18/h2-3,10,12-14,19H,4-9H2,1H3/b15-10+