3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide

Systemtic Name: 3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide Openeye Name: 3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide CAS Name: 3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide IUPAC Name: 3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide Traditional Name: 3,5-dinitro-N-[2-(3-phenylpropoxy)phenyl]benzamide Formula: C22H19N3O6 MolecularWeight: 421.40276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=CC=C2NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=CC=C2NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O6/c26-22(17-13-18(24(27)28)15-19(14-17)25(29)30)23-20-10-4-5-11-21(20)31-12-6-9-16-7-2-1-3-8-16/h1-5,7-8,10-11,13-15H,6,9,12H2,(H,23,26)