3,5-dinitro-N-(4-phenylbutyl)benzamide

Systemtic Name: 3,5-dinitro-N-(4-phenylbutyl)benzamide Openeye Name: 3,5-dinitro-N-(4-phenylbutyl)benzamide CAS Name: 3,5-dinitro-N-(4-phenylbutyl)benzamide IUPAC Name: 3,5-dinitro-N-(4-phenylbutyl)benzamide Traditional Name: 3,5-dinitro-N-(4-phenylbutyl)benzamide Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O5/c21-17(18-9-5-4-8-13-6-2-1-3-7-13)14-10-15(19(22)23)12-16(11-14)20(24)25/h1-3,6-7,10-12H,4-5,8-9H2,(H,18,21)