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

Systemtic Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-hexyl-benzene Openeye Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-hexyl-benzene CAS Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-hexylbenzene IUPAC Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-hexylbenzene Traditional Name: 1-[4,4-bis[4-(4-nitrophenoxy)phenyl]cyclohexyl]-4-hexyl-benzene Formula: C42H42N2O6 MolecularWeight: 670.79268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=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

CCCCCCC1=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/C42H42N2O6/c1-2-3-4-5-6-31-7-9-32(10-8-31)33-27-29-42(30-28-33,34-11-19-38(20-12-34)49-40-23-15-36(16-24-40)43(45)46)35-13-21-39(22-14-35)50-41-25-17-37(18-26-41)44(47)48/h7-26,33H,2-6,27-30H2,1H3