(6E)-2-nitro-6-(1-octylimidazolidin-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-nitro-6-(1-octylimidazolidin-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-nitro-6-(1-octylimidazolidin-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-nitro-6-(1-octyl-2-imidazolidinylidene)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-nitro-6-(1-octylimidazolidin-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-nitro-6-(1-octylimidazolidin-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CCNC1=C2C=CC=C(C2=O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCN\1CCN/C1=C\2/C=CC=C(C2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O3/c1-2-3-4-5-6-7-12-19-13-11-18-17(19)14-9-8-10-15(16(14)21)20(22)23/h8-10,18H,2-7,11-13H2,1H3/b17-14+