2-[(4-tert-butylphenyl)amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-(4-tert-butylanilino)-5-nitro-benzonitrile CAS Name: 2-(4-tert-butylanilino)-5-nitrobenzonitrile IUPAC Name: 2-(4-tert-butylanilino)-5-nitrobenzonitrile Traditional Name: 2-(4-tert-butylanilino)-5-nitro-benzonitrile Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2/c1-17(2,3)13-4-6-14(7-5-13)19-16-9-8-15(20(21)22)10-12(16)11-18/h4-10,19H,1-3H3