1-nitro-4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]benzene

Systemtic Name: 1-nitro-4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]benzene Openeye Name: 1-nitro-4-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]benzene CAS Name: 1-nitro-4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]benzene IUPAC Name: 1-nitro-4-[[4-(2,4,4-trimethylpentan-2-yl)phenoxy]methyl]benzene Traditional Name: 1-nitro-4-[[4-(1,1,3,3-tetramethylbutyl)phenoxy]methyl]benzene Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H27NO3/c1-20(2,3)15-21(4,5)17-8-12-19(13-9-17)25-14-16-6-10-18(11-7-16)22(23)24/h6-13H,14-15H2,1-5H3