1-(chloromethyl)-4-[7-(4-iodophenyl)-2,2-dimethyl-5-phenyl-octan-3-yl]benzene

Systemtic Name: 1-(chloromethyl)-4-[7-(4-iodophenyl)-2,2-dimethyl-5-phenyl-octan-3-yl]benzene Openeye Name: 1-[1-tert-butyl-5-(4-iodophenyl)-3-phenyl-hexyl]-4-(chloromethyl)benzene CAS Name: 1-(chloromethyl)-4-[7-(4-iodophenyl)-2,2-dimethyl-5-phenyloctan-3-yl]benzene IUPAC Name: 1-(chloromethyl)-4-[7-(4-iodophenyl)-2,2-dimethyl-5-phenyloctan-3-yl]benzene Traditional Name: 1-[1-tert-butyl-5-(4-iodophenyl)-3-phenyl-hexyl]-4-(chloromethyl)benzene Formula: C29H34ClI MolecularWeight: 544.93773

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(C1=CC=C(C=C1)CCl)C(C)(C)C)C2=CC=CC=C2)C3=CC=C(C=C3)I

Isomeric SMILES

CC(CC(CC(C1=CC=C(C=C1)CCl)C(C)(C)C)C2=CC=CC=C2)C3=CC=C(C=C3)I

InChI

InChI=1S/C29H34ClI/c1-21(23-14-16-27(31)17-15-23)18-26(24-8-6-5-7-9-24)19-28(29(2,3)4)25-12-10-22(20-30)11-13-25/h5-17,21,26,28H,18-20H2,1-4H3