methyl 2-[4-(2-bromanyldibenzothiophen-1-yl)phenoxy]ethanoate

Systemtic Name: methyl 2-[4-(2-bromanyldibenzothiophen-1-yl)phenoxy]ethanoate Openeye Name: methyl 2-[4-(2-bromodibenzothiophen-1-yl)phenoxy]acetate CAS Name: 2-[4-(2-bromo-1-dibenzothiophenyl)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(2-bromodibenzothiophen-1-yl)phenoxy]acetate Traditional Name: 2-[4-(2-bromodibenzothiophen-1-yl)phenoxy]acetic acid methyl ester Formula: C21H15BrO3S MolecularWeight: 427.311

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)C2=C(C=CC3=C2C4=CC=CC=C4S3)Br

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)C2=C(C=CC3=C2C4=CC=CC=C4S3)Br

InChI

InChI=1S/C21H15BrO3S/c1-24-19(23)12-25-14-8-6-13(7-9-14)20-16(22)10-11-18-21(20)15-4-2-3-5-17(15)26-18/h2-11H,12H2,1H3