1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propyl-benzene

Systemtic Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propyl-benzene Openeye Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propyl-benzene CAS Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propylbenzene IUPAC Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propylbenzene Traditional Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-propyl-benzene Formula: C39H36N2O6 MolecularWeight: 628.71294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2CCC(CC2)(C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)OC6=CC=C(C=C6)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)C2CCC(CC2)(C3=CC=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)OC6=CC=C(C=C6)[N+](=O)[O-]

InChI

InChI=1S/C39H36N2O6/c1-2-3-28-4-6-29(7-5-28)30-24-26-39(27-25-30,31-8-16-35(17-9-31)46-37-20-12-33(13-21-37)40(42)43)32-10-18-36(19-11-32)47-38-22-14-34(15-23-38)41(44)45/h4-23,30H,2-3,24-27H2,1H3