4-(4-decoxyphenyl)-2-nitro-1-octan-2-yloxy-benzene

Systemtic Name: 4-(4-decoxyphenyl)-2-nitro-1-octan-2-yloxy-benzene Openeye Name: 4-(4-decoxyphenyl)-1-(1-methylheptoxy)-2-nitro-benzene CAS Name: 4-(4-decoxyphenyl)-2-nitro-1-octan-2-yloxybenzene IUPAC Name: 4-(4-decoxyphenyl)-2-nitro-1-octan-2-yloxybenzene Traditional Name: 4-(4-decoxyphenyl)-1-(1-methylheptoxy)-2-nitro-benzene Formula: C30H45NO4 MolecularWeight: 483.6826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(C)CCCCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(C)CCCCCC)[N+](=O)[O-]

InChI

InChI=1S/C30H45NO4/c1-4-6-8-10-11-12-13-15-23-34-28-20-17-26(18-21-28)27-19-22-30(29(24-27)31(32)33)35-25(3)16-14-9-7-5-2/h17-22,24-25H,4-16,23H2,1-3H3