4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitro-benzene

Systemtic Name: 4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitro-benzene Openeye Name: 4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitro-benzene CAS Name: 4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitrobenzene IUPAC Name: 4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitrobenzene Traditional Name: 4-[4-(4-decoxyphenyl)phenyl]-1-(2-methylbutoxy)-2-nitro-benzene Formula: C33H43NO4 MolecularWeight: 517.69882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)[N+](=O)[O-]

InChI

InChI=1S/C33H43NO4/c1-4-6-7-8-9-10-11-12-23-37-31-20-17-28(18-21-31)27-13-15-29(16-14-27)30-19-22-33(32(24-30)34(35)36)38-25-26(3)5-2/h13-22,24,26H,4-12,23,25H2,1-3H3