(E)-1-(4-bromanylthiophen-2-yl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromanylthiophen-2-yl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-bromo-2-thienyl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-bromo-2-thiophenyl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-bromothiophen-2-yl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-bromo-2-thienyl)-3-[4-methoxy-3-(phenoxymethyl)phenyl]prop-2-en-1-one Formula: C21H17BrO3S MolecularWeight: 429.32688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC(=CS2)Br)COC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC(=CS2)Br)COC3=CC=CC=C3

InChI

InChI=1S/C21H17BrO3S/c1-24-20-10-8-15(7-9-19(23)21-12-17(22)14-26-21)11-16(20)13-25-18-5-3-2-4-6-18/h2-12,14H,13H2,1H3/b9-7+