(E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzothiazol-2-yl)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)prop-2-en-1-one Formula: C17H12BrNO3S MolecularWeight: 390.25108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)C=CC(=O)C2=NC3=CC=CC=C3S2)O

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)/C=C/C(=O)C2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C17H12BrNO3S/c1-22-15-9-11(18)10(8-14(15)21)6-7-13(20)17-19-12-4-2-3-5-16(12)23-17/h2-9,21H,1H3/b7-6+