3-[3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione

Systemtic Name: 3-[3-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione Openeye Name: 3-[3-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)prop-2-enoyl]-6-methyl-pyran-2,4-dione CAS Name: 3-[3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)-1-oxoprop-2-enyl]-6-methylpyran-2,4-dione IUPAC Name: 3-[3-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)prop-2-enoyl]-6-methylpyran-2,4-dione Traditional Name: 3-[3-(4-benzoxy-3-bromo-5-ethoxy-phenyl)acryloyl]-6-methyl-pyran-2,4-quinone Formula: C24H21BrO6 MolecularWeight: 485.32394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)C2C(=O)C=C(OC2=O)C)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=CC(=O)C2C(=O)C=C(OC2=O)C)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C24H21BrO6/c1-3-29-21-13-17(9-10-19(26)22-20(27)11-15(2)31-24(22)28)12-18(25)23(21)30-14-16-7-5-4-6-8-16/h4-13,22H,3,14H2,1-2H3