3-[methyl-[(2-methyl-3-nitro-phenyl)methyl]amino]propanenitrile

Systemtic Name: 3-[methyl-[(2-methyl-3-nitro-phenyl)methyl]amino]propanenitrile Openeye Name: 3-[methyl-[(2-methyl-3-nitro-phenyl)methyl]amino]propanenitrile CAS Name: 3-[methyl-[(2-methyl-3-nitrophenyl)methyl]amino]propanenitrile IUPAC Name: 3-[methyl-[(2-methyl-3-nitrophenyl)methyl]amino]propanenitrile Traditional Name: 3-[methyl-(2-methyl-3-nitro-benzyl)amino]propionitrile Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O2/c1-10-11(9-14(2)8-4-7-13)5-3-6-12(10)15(16)17/h3,5-6H,4,8-9H2,1-2H3