3-[(E)-3-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)prop-2-enoyl]-6-methyl-4-oxidanylidene-pyran-2-olate

Systemtic Name: 3-[(E)-3-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)prop-2-enoyl]-6-methyl-4-oxidanylidene-pyran-2-olate Openeye Name: 3-[(E)-3-(3-bromo-5-ethoxy-4-hydroxy-phenyl)prop-2-enoyl]-6-methyl-4-oxo-pyran-2-olate CAS Name: 3-[(E)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1-oxoprop-2-enyl]-6-methyl-4-oxo-2-pyranolate IUPAC Name: 3-[(E)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)prop-2-enoyl]-6-methyl-4-oxopyran-2-olate Traditional Name: 3-[(E)-3-(3-bromo-5-ethoxy-4-hydroxy-phenyl)acryloyl]-4-keto-6-methyl-pyran-2-olate Formula: C17H14BrO6- MolecularWeight: 394.19346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)C2=C(OC(=CC2=O)C)[O-])Br)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)C2=C(OC(=CC2=O)C)[O-])Br)O

InChI

InChI=1S/C17H15BrO6/c1-3-23-14-8-10(7-11(18)16(14)21)4-5-12(19)15-13(20)6-9(2)24-17(15)22/h4-8,21-22H,3H2,1-2H3/p-1/b5-4+