4-[3-bromanyl-4-[2-(phenylmethyl)-1-benzothiophen-3-yl]phenyl]-2-(3-methoxyphenyl)phenol

Systemtic Name: 4-[3-bromanyl-4-[2-(phenylmethyl)-1-benzothiophen-3-yl]phenyl]-2-(3-methoxyphenyl)phenol Openeye Name: 4-[4-(2-benzylbenzothiophen-3-yl)-3-bromo-phenyl]-2-(3-methoxyphenyl)phenol CAS Name: 4-[3-bromo-4-[2-(phenylmethyl)-1-benzothiophen-3-yl]phenyl]-2-(3-methoxyphenyl)phenol IUPAC Name: 4-[4-(2-benzyl-1-benzothiophen-3-yl)-3-bromophenyl]-2-(3-methoxyphenyl)phenol Traditional Name: 4-[4-(2-benzylbenzothiophen-3-yl)-3-bromo-phenyl]-2-(3-methoxyphenyl)phenol Formula: C34H25BrO2S MolecularWeight: 577.5301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C=CC(=C2)C3=CC(=C(C=C3)C4=C(SC5=CC=CC=C54)CC6=CC=CC=C6)Br)O

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C=CC(=C2)C3=CC(=C(C=C3)C4=C(SC5=CC=CC=C54)CC6=CC=CC=C6)Br)O

InChI

InChI=1S/C34H25BrO2S/c1-37-26-11-7-10-25(19-26)29-20-23(15-17-31(29)36)24-14-16-27(30(35)21-24)34-28-12-5-6-13-32(28)38-33(34)18-22-8-3-2-4-9-22/h2-17,19-21,36H,18H2,1H3