2-[(4-methylphenyl)methylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(4-methylphenyl)methylamino]-5-nitro-benzenecarbonitrile Openeye Name: 5-nitro-2-(p-tolylmethylamino)benzonitrile CAS Name: 2-[(4-methylphenyl)methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(4-methylphenyl)methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(4-methylbenzyl)amino]-5-nitro-benzonitrile Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H13N3O2/c1-11-2-4-12(5-3-11)10-17-15-7-6-14(18(19)20)8-13(15)9-16/h2-8,17H,10H2,1H3