3-methyl-5-nitro-benzenecarbonitrile

Systemtic Name: 3-methyl-5-nitro-benzenecarbonitrile Openeye Name: 3-methyl-5-nitro-benzonitrile CAS Name: 3-methyl-5-nitrobenzonitrile IUPAC Name: 3-methyl-5-nitrobenzonitrile Traditional Name: 3-methyl-5-nitro-benzonitrile Formula: C8H6N2O2 MolecularWeight: 162.14544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6N2O2/c1-6-2-7(5-9)4-8(3-6)10(11)12/h2-4H,1H3