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

Systemtic Name: 4-[3-bromanyl-4-[2-(phenylmethyl)-1-benzothiophen-3-yl]phenyl]-2-(3,4-dimethoxyphenyl)phenol Openeye Name: 4-[4-(2-benzylbenzothiophen-3-yl)-3-bromo-phenyl]-2-(3,4-dimethoxyphenyl)phenol CAS Name: 4-[3-bromo-4-[2-(phenylmethyl)-1-benzothiophen-3-yl]phenyl]-2-(3,4-dimethoxyphenyl)phenol IUPAC Name: 4-[4-(2-benzyl-1-benzothiophen-3-yl)-3-bromophenyl]-2-(3,4-dimethoxyphenyl)phenol Traditional Name: 4-[4-(2-benzylbenzothiophen-3-yl)-3-bromo-phenyl]-2-(3,4-dimethoxyphenyl)phenol Formula: C35H27BrO3S MolecularWeight: 607.55608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H27BrO3S/c1-38-31-17-14-25(21-32(31)39-2)28-19-23(13-16-30(28)37)24-12-15-26(29(36)20-24)35-27-10-6-7-11-33(27)40-34(35)18-22-8-4-3-5-9-22/h3-17,19-21,37H,18H2,1-2H3