6-bromanyl-3-[(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]chromen-2-one Openeye Name: 6-bromo-3-[(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]chromen-2-one CAS Name: 6-bromo-3-[(E)-1-oxo-3-(2,3,4-trimethoxyphenyl)prop-2-enyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[(E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoyl]chromen-2-one Traditional Name: 6-bromo-3-[(E)-3-(2,3,4-trimethoxyphenyl)acryloyl]coumarin Formula: C21H17BrO6 MolecularWeight: 445.26008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=CC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=C/C(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O)OC)OC

InChI

InChI=1S/C21H17BrO6/c1-25-18-8-5-12(19(26-2)20(18)27-3)4-7-16(23)15-11-13-10-14(22)6-9-17(13)28-21(15)24/h4-11H,1-3H3/b7-4+