2-[(2,4-dimethylphenyl)methyl-methyl-amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl-methyl-amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(2,4-dimethylphenyl)methyl-methyl-amino]-5-nitro-benzonitrile CAS Name: 2-[(2,4-dimethylphenyl)methyl-methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(2,4-dimethylphenyl)methyl-methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(2,4-dimethylbenzyl)-methyl-amino]-5-nitro-benzonitrile Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O2/c1-12-4-5-14(13(2)8-12)11-19(3)17-7-6-16(20(21)22)9-15(17)10-18/h4-9H,11H2,1-3H3