N-(3,3-diphenylpropyl)-3,5-dinitro-benzamide

Systemtic Name: N-(3,3-diphenylpropyl)-3,5-dinitro-benzamide Openeye Name: N-(3,3-diphenylpropyl)-3,5-dinitro-benzamide CAS Name: N-(3,3-diphenylpropyl)-3,5-dinitrobenzamide IUPAC Name: N-(3,3-diphenylpropyl)-3,5-dinitrobenzamide Traditional Name: N-(3,3-diphenylpropyl)-3,5-dinitro-benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CCNC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H19N3O5/c26-22(18-13-19(24(27)28)15-20(14-18)25(29)30)23-12-11-21(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,13-15,21H,11-12H2,(H,23,26)