5-bromanyl-4-methoxy-6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]pyran-2-one

Systemtic Name: 5-bromanyl-4-methoxy-6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]pyran-2-one Openeye Name: 5-bromo-4-methoxy-6-methyl-3-[(E)-3-(m-tolyl)prop-2-enoyl]pyran-2-one CAS Name: 5-bromo-4-methoxy-6-methyl-3-[(E)-3-(3-methylphenyl)-1-oxoprop-2-enyl]-2-pyranone IUPAC Name: 5-bromo-4-methoxy-6-methyl-3-[(E)-3-(3-methylphenyl)prop-2-enoyl]pyran-2-one Traditional Name: 5-bromo-4-methoxy-6-methyl-3-[(E)-3-(m-tolyl)acryloyl]pyran-2-one Formula: C17H15BrO4 MolecularWeight: 363.2026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CC(=O)C2=C(C(=C(OC2=O)C)Br)OC

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/C(=O)C2=C(C(=C(OC2=O)C)Br)OC

InChI

InChI=1S/C17H15BrO4/c1-10-5-4-6-12(9-10)7-8-13(19)14-16(21-3)15(18)11(2)22-17(14)20/h4-9H,1-3H3/b8-7+