3,5-dinitro-4-[(phenylmethyl)amino]benzenecarbonitrile

Systemtic Name: 3,5-dinitro-4-[(phenylmethyl)amino]benzenecarbonitrile Openeye Name: 4-(benzylamino)-3,5-dinitro-benzonitrile CAS Name: 3,5-dinitro-4-[(phenylmethyl)amino]benzonitrile IUPAC Name: 4-(benzylamino)-3,5-dinitrobenzonitrile Traditional Name: 4-(benzylamino)-3,5-dinitro-benzonitrile Formula: C14H10N4O4 MolecularWeight: 298.2536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N4O4/c15-8-11-6-12(17(19)20)14(13(7-11)18(21)22)16-9-10-4-2-1-3-5-10/h1-7,16H,9H2