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

Systemtic Name: 3-[(4-methyl-3-nitro-phenyl)methylamino]propanenitrile Openeye Name: 3-[(4-methyl-3-nitro-phenyl)methylamino]propanenitrile CAS Name: 3-[(4-methyl-3-nitrophenyl)methylamino]propanenitrile IUPAC Name: 3-[(4-methyl-3-nitrophenyl)methylamino]propanenitrile Traditional Name: 3-[(4-methyl-3-nitro-benzyl)amino]propionitrile Formula: C11H13N3O2 MolecularWeight: 219.23982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O2/c1-9-3-4-10(7-11(9)14(15)16)8-13-6-2-5-12/h3-4,7,13H,2,6,8H2,1H3