1-[2-(4,4-dimethylpentan-2-yl)-5,7,7-trimethyl-octoxy]-2-nitro-benzene

Systemtic Name: 1-[2-(4,4-dimethylpentan-2-yl)-5,7,7-trimethyl-octoxy]-2-nitro-benzene Openeye Name: 1-nitro-2-[5,7,7-trimethyl-2-(1,3,3-trimethylbutyl)octoxy]benzene CAS Name: 1-[2-(4,4-dimethylpentan-2-yl)-5,7,7-trimethyloctoxy]-2-nitrobenzene IUPAC Name: 1-[2-(4,4-dimethylpentan-2-yl)-5,7,7-trimethyloctoxy]-2-nitrobenzene Traditional Name: 1-nitro-2-[5,7,7-trimethyl-2-(1,3,3-trimethylbutyl)octoxy]benzene Formula: C24H41NO3 MolecularWeight: 391.58724

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(COC1=CC=CC=C1[N+](=O)[O-])C(C)CC(C)(C)C)CC(C)(C)C

Isomeric SMILES

CC(CCC(COC1=CC=CC=C1[N+](=O)[O-])C(C)CC(C)(C)C)CC(C)(C)C

InChI

InChI=1S/C24H41NO3/c1-18(15-23(3,4)5)13-14-20(19(2)16-24(6,7)8)17-28-22-12-10-9-11-21(22)25(26)27/h9-12,18-20H,13-17H2,1-8H3