5-tert-butyl-1,3-dimethyl-2-nitro-benzene

Systemtic Name: 5-tert-butyl-1,3-dimethyl-2-nitro-benzene Openeye Name: 5-tert-butyl-1,3-dimethyl-2-nitro-benzene CAS Name: 5-tert-butyl-1,3-dimethyl-2-nitrobenzene IUPAC Name: 5-tert-butyl-1,3-dimethyl-2-nitrobenzene Traditional Name: 5-tert-butyl-1,3-dimethyl-2-nitro-benzene Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-8-6-10(12(3,4)5)7-9(2)11(8)13(14)15/h6-7H,1-5H3