3-[methyl-(3-methyl-4-nitro-phenyl)amino]propanenitrile

Systemtic Name: 3-[methyl-(3-methyl-4-nitro-phenyl)amino]propanenitrile Openeye Name: 3-(N,3-dimethyl-4-nitro-anilino)propanenitrile CAS Name: 3-(N,3-dimethyl-4-nitroanilino)propanenitrile IUPAC Name: 3-(N,3-dimethyl-4-nitroanilino)propanenitrile Traditional Name: 3-(N,3-dimethyl-4-nitro-anilino)propionitrile Formula: C11H13N3O2 MolecularWeight: 219.23982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O2/c1-9-8-10(13(2)7-3-6-12)4-5-11(9)14(15)16/h4-5,8H,3,7H2,1-2H3