5-[(3-cyanophenyl)methylamino]-2,4-dinitro-benzamide

Systemtic Name: 5-[(3-cyanophenyl)methylamino]-2,4-dinitro-benzamide Openeye Name: 5-[(3-cyanophenyl)methylamino]-2,4-dinitro-benzamide CAS Name: 5-[(3-cyanophenyl)methylamino]-2,4-dinitrobenzamide IUPAC Name: 5-[(3-cyanophenyl)methylamino]-2,4-dinitrobenzamide Traditional Name: 5-[(3-cyanobenzyl)amino]-2,4-dinitro-benzamide Formula: C15H11N5O5 MolecularWeight: 341.27834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-])C#N

InChI

InChI=1S/C15H11N5O5/c16-7-9-2-1-3-10(4-9)8-18-12-5-11(15(17)21)13(19(22)23)6-14(12)20(24)25/h1-6,18H,8H2,(H2,17,21)