1,2,3,4-tetrakis[4-(2-iodanylpropyl)phenyl]biphenylene

Systemtic Name: 1,2,3,4-tetrakis[4-(2-iodanylpropyl)phenyl]biphenylene Openeye Name: 1,2,3,4-tetrakis[4-(2-iodopropyl)phenyl]biphenylene CAS Name: 1,2,3,4-tetrakis[4-(2-iodopropyl)phenyl]biphenylene IUPAC Name: 1,2,3,4-tetrakis[4-(2-iodopropyl)phenyl]biphenylene Traditional Name: 1,2,3,4-tetrakis[4-(2-iodopropyl)phenyl]biphenylene Formula: C48H44I4 MolecularWeight: 1128.48084

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C2=C(C(=C3C4=CC=CC=C4C3=C2C5=CC=C(C=C5)CC(C)I)C6=CC=C(C=C6)CC(C)I)C7=CC=C(C=C7)CC(C)I)I

Isomeric SMILES

CC(CC1=CC=C(C=C1)C2=C(C(=C3C4=CC=CC=C4C3=C2C5=CC=C(C=C5)CC(C)I)C6=CC=C(C=C6)CC(C)I)C7=CC=C(C=C7)CC(C)I)I

InChI

InChI=1S/C48H44I4/c1-29(49)25-33-9-17-37(18-10-33)43-44(38-19-11-34(12-20-38)26-30(2)50)46(40-23-15-36(16-24-40)28-32(4)52)48-42-8-6-5-7-41(42)47(48)45(43)39-21-13-35(14-22-39)27-31(3)51/h5-24,29-32H,25-28H2,1-4H3