(9E)-N-(1,3-diphenylpropan-2-yl)-9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxamide

Systemtic Name: (9E)-N-(1,3-diphenylpropan-2-yl)-9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxamide Openeye Name: (9E)-N-(1-benzyl-2-phenyl-ethyl)-9-hydroxyimino-2,5,7-trinitro-fluorene-4-carboxamide CAS Name: (9E)-N-(1,3-diphenylpropan-2-yl)-9-hydroxyimino-2,5,7-trinitro-4-fluorenecarboxamide IUPAC Name: (9E)-N-(1,3-diphenylpropan-2-yl)-9-hydroxyimino-2,5,7-trinitrofluorene-4-carboxamide Traditional Name: (9E)-N-(1-benzyl-2-phenyl-ethyl)-9-hydroximino-2,5,7-trinitro-fluorene-4-carboxamide Formula: C29H21N5O8 MolecularWeight: 567.50574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)NC(=O)C3=C4C(=CC(=C3)[N+](=O)[O-])C(=NO)C5=CC(=CC(=C54)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=CC=C2)NC(=O)C3=C4C(=CC(=C3)[N+](=O)[O-])/C(=N\O)/C5=CC(=CC(=C54)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C29H21N5O8/c35-29(30-19(11-17-7-3-1-4-8-17)12-18-9-5-2-6-10-18)24-15-20(32(37)38)13-22-26(24)27-23(28(22)31-36)14-21(33(39)40)16-25(27)34(41)42/h1-10,13-16,19,36H,11-12H2,(H,30,35)/b31-28+