[3,4-bis(bromanyl)-2-octadecyl-phenyl] prop-2-enoate

Systemtic Name: [3,4-bis(bromanyl)-2-octadecyl-phenyl] prop-2-enoate Openeye Name: (3,4-dibromo-2-octadecyl-phenyl) prop-2-enoate CAS Name: 2-propenoic acid (3,4-dibromo-2-octadecylphenyl) ester IUPAC Name: (3,4-dibromo-2-octadecylphenyl) prop-2-enoate Traditional Name: acrylic acid (3,4-dibromo-2-stearyl-phenyl) ester Formula: C27H42Br2O2 MolecularWeight: 558.42918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1Br)Br)OC(=O)C=C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1Br)Br)OC(=O)C=C

InChI

InChI=1S/C27H42Br2O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-25(31-26(30)4-2)22-21-24(28)27(23)29/h4,21-22H,2-3,5-20H2,1H3