1-(3,3-dimethyl-1-nitro-butan-2-yl)oxyethylbenzene

Systemtic Name: 1-(3,3-dimethyl-1-nitro-butan-2-yl)oxyethylbenzene Openeye Name: 1-[2,2-dimethyl-1-(nitromethyl)propoxy]ethylbenzene CAS Name: 1-(3,3-dimethyl-1-nitrobutan-2-yl)oxyethylbenzene IUPAC Name: 1-(3,3-dimethyl-1-nitrobutan-2-yl)oxyethylbenzene Traditional Name: 1-[2,2-dimethyl-1-(nitromethyl)propoxy]ethylbenzene Formula: C14H21NO3 MolecularWeight: 251.32144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO3/c1-11(12-8-6-5-7-9-12)18-13(10-15(16)17)14(2,3)4/h5-9,11,13H,10H2,1-4H3