(9E)-9-[(4-heptoxyphenyl)methylidene]-2,4,7-trinitro-fluorene

Systemtic Name: (9E)-9-[(4-heptoxyphenyl)methylidene]-2,4,7-trinitro-fluorene Openeye Name: (9E)-9-[(4-heptoxyphenyl)methylene]-2,4,7-trinitro-fluorene CAS Name: (9E)-9-[(4-heptoxyphenyl)methylidene]-2,4,7-trinitrofluorene IUPAC Name: (9E)-9-[(4-heptoxyphenyl)methylidene]-2,4,7-trinitrofluorene Traditional Name: (9E)-9-(4-heptoxybenzylidene)-2,4,7-trinitro-fluorene Formula: C27H25N3O7 MolecularWeight: 503.5033

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C=C2C3=CC(=CC(=C3C4=C2C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)/C=C\2/C3=CC(=CC(=C3C4=C2C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C27H25N3O7/c1-2-3-4-5-6-13-37-21-10-7-18(8-11-21)14-23-24-15-19(28(31)32)9-12-22(24)27-25(23)16-20(29(33)34)17-26(27)30(35)36/h7-12,14-17H,2-6,13H2,1H3/b23-14+