4-[(3,4-dimethylphenyl)amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(3,4-dimethylphenyl)amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-(3,4-dimethylanilino)-3-nitro-benzonitrile CAS Name: 4-(3,4-dimethylanilino)-3-nitrobenzonitrile IUPAC Name: 4-(3,4-dimethylanilino)-3-nitrobenzonitrile Traditional Name: 4-(3,4-dimethylanilino)-3-nitro-benzonitrile Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O2/c1-10-3-5-13(7-11(10)2)17-14-6-4-12(9-16)8-15(14)18(19)20/h3-8,17H,1-2H3