1-benzothiophen-3-yl-[4-(2-bromoethyloxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone

Systemtic Name: 1-benzothiophen-3-yl-[4-(2-bromoethyloxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone Openeye Name: benzothiophen-3-yl-[4-(2-bromoethoxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone CAS Name: 1-benzothiophen-3-yl-[4-(2-bromoethoxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone IUPAC Name: 1-benzothiophen-3-yl-[4-(2-bromoethoxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone Traditional Name: benzothiophen-3-yl-[4-(2-bromoethoxy)-2-methyl-6-(2,3,4-trimethoxyphenyl)phenyl]methanone Formula: C27H25BrO5S MolecularWeight: 541.4534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)OCCBr)C2=C(C(=C(C=C2)OC)OC)OC)C(=O)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=CC(=C1)OCCBr)C2=C(C(=C(C=C2)OC)OC)OC)C(=O)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C27H25BrO5S/c1-16-13-17(33-12-11-28)14-20(19-9-10-22(30-2)27(32-4)26(19)31-3)24(16)25(29)21-15-34-23-8-6-5-7-18(21)23/h5-10,13-15H,11-12H2,1-4H3