3-[(E)-3-(3-bromanyl-5-methoxy-4-propoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione

Systemtic Name: 3-[(E)-3-(3-bromanyl-5-methoxy-4-propoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[(E)-3-(3-bromo-5-methoxy-4-propoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[(E)-3-(3-bromo-5-methoxy-4-propoxyphenyl)-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[(E)-3-(3-bromo-5-methoxy-4-propoxyphenyl)prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[(E)-3-(3-bromo-5-methoxy-4-propoxy-phenyl)acryloyl]-6-methyl-pyran-2,4-quinone Formula: C19H19BrO6 MolecularWeight: 423.25456

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C=CC(=O)C2C(=O)C=C(OC2=O)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)/C=C/C(=O)C2C(=O)C=C(OC2=O)C)OC

InChI

InChI=1S/C19H19BrO6/c1-4-7-25-18-13(20)9-12(10-16(18)24-3)5-6-14(21)17-15(22)8-11(2)26-19(17)23/h5-6,8-10,17H,4,7H2,1-3H3/b6-5+