1-tert-butyl-3-nitro-2-propyl-benzene

Systemtic Name: 1-tert-butyl-3-nitro-2-propyl-benzene Openeye Name: 1-tert-butyl-3-nitro-2-propyl-benzene CAS Name: 1-tert-butyl-3-nitro-2-propylbenzene IUPAC Name: 1-tert-butyl-3-nitro-2-propylbenzene Traditional Name: 1-tert-butyl-3-nitro-2-propyl-benzene Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CCCC1=C(C=CC=C1[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C13H19NO2/c1-5-7-10-11(13(2,3)4)8-6-9-12(10)14(15)16/h6,8-9H,5,7H2,1-4H3