2-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-3-oxidanyl-4,6,6-tripropyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 2-[(E)-3-(4-bromophenyl)prop-2-enoyl]-5-methoxy-3-oxidanyl-4,6,6-tripropyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-[(E)-3-(4-bromophenyl)prop-2-enoyl]-3-hydroxy-5-methoxy-4,6,6-tripropyl-cyclohexa-2,4-dien-1-one CAS Name: 2-[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]-3-hydroxy-5-methoxy-4,6,6-tripropyl-1-cyclohexa-2,4-dienone IUPAC Name: 2-[(E)-3-(4-bromophenyl)prop-2-enoyl]-3-hydroxy-5-methoxy-4,6,6-tripropylcyclohexa-2,4-dien-1-one Traditional Name: 2-[(E)-3-(4-bromophenyl)acryloyl]-3-hydroxy-5-methoxy-4,6,6-tripropyl-cyclohexa-2,4-dien-1-one Formula: C25H31BrO4 MolecularWeight: 475.41524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C(=O)C(=C1O)C(=O)C=CC2=CC=C(C=C2)Br)(CCC)CCC)OC

Isomeric SMILES

CCCC1=C(C(C(=O)C(=C1O)C(=O)/C=C/C2=CC=C(C=C2)Br)(CCC)CCC)OC

InChI

InChI=1S/C25H31BrO4/c1-5-8-19-22(28)21(20(27)14-11-17-9-12-18(26)13-10-17)23(29)25(15-6-2,16-7-3)24(19)30-4/h9-14,28H,5-8,15-16H2,1-4H3/b14-11+