9-(dicyanomethylidene)-2,5,7-trinitro-N-octadecyl-fluorene-4-carboxamide

Systemtic Name: 9-(dicyanomethylidene)-2,5,7-trinitro-N-octadecyl-fluorene-4-carboxamide Openeye Name: 9-(dicyanomethylene)-2,5,7-trinitro-N-octadecyl-fluorene-4-carboxamide CAS Name: 9-(dicyanomethylidene)-2,5,7-trinitro-N-octadecyl-4-fluorenecarboxamide IUPAC Name: 9-(dicyanomethylidene)-2,5,7-trinitro-N-octadecylfluorene-4-carboxamide Traditional Name: 9-(dicyanomethylene)-2,5,7-trinitro-N-stearyl-fluorene-4-carboxamide Formula: C35H42N6O7 MolecularWeight: 658.74398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C#N)C#N)C3=CC(=CC(=C32)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C35H42N6O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-38-35(42)30-21-26(39(43)44)19-28-32(25(23-36)24-37)29-20-27(40(45)46)22-31(41(47)48)34(29)33(28)30/h19-22H,2-18H2,1H3,(H,38,42)