ethanenitrile; N-methyl-4-nitro-aniline

Systemtic Name: ethanenitrile; N-methyl-4-nitro-aniline Openeye Name: acetonitrile; N-methyl-4-nitro-aniline CAS Name: acetonitrile; N-methyl-4-nitroaniline IUPAC Name: acetonitrile; N-methyl-4-nitroaniline Traditional Name: acetonitrile; methyl-(4-nitrophenyl)amine Formula: C9H11N3O2 MolecularWeight: 193.20254

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CNC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC#N.CNC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C7H8N2O2.C2H3N/c1-8-6-2-4-7(5-3-6)9(10)11;1-2-3/h2-5,8H,1H3;1H3