5-[(E)-2-benzo[e][1,3]benzothiazol-2-ylethenyl]-4-bromanyl-2-methoxy-phenol

Systemtic Name: 5-[(E)-2-benzo[e][1,3]benzothiazol-2-ylethenyl]-4-bromanyl-2-methoxy-phenol Openeye Name: 5-[(E)-2-benzo[e][1,3]benzothiazol-2-ylvinyl]-4-bromo-2-methoxy-phenol CAS Name: 5-[(E)-2-(2-benzo[e][1,3]benzothiazolyl)ethenyl]-4-bromo-2-methoxyphenol IUPAC Name: 5-[(E)-2-benzo[e][1,3]benzothiazol-2-ylethenyl]-4-bromo-2-methoxyphenol Traditional Name: 5-[(E)-2-benzo[e][1,3]benzothiazol-2-ylvinyl]-4-bromo-2-methoxy-phenol Formula: C20H14BrNO2S MolecularWeight: 412.29966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=CC2=NC3=C(S2)C=CC4=CC=CC=C43)O

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)/C=C/C2=NC3=C(S2)C=CC4=CC=CC=C43)O

InChI

InChI=1S/C20H14BrNO2S/c1-24-17-11-15(21)13(10-16(17)23)7-9-19-22-20-14-5-3-2-4-12(14)6-8-18(20)25-19/h2-11,23H,1H3/b9-7+