cyclohexa-1,3-dien-1-yl 3-bromanyl-4-dodecoxy-benzoate

Systemtic Name: cyclohexa-1,3-dien-1-yl 3-bromanyl-4-dodecoxy-benzoate Openeye Name: cyclohexa-1,3-dien-1-yl 3-bromo-4-dodecoxy-benzoate CAS Name: 3-bromo-4-dodecoxybenzoic acid 1-cyclohexa-1,3-dienyl ester IUPAC Name: cyclohexa-1,3-dien-1-yl 3-bromo-4-dodecoxybenzoate Traditional Name: 3-bromo-4-lauryloxy-benzoic acid cyclohexa-1,3-dien-1-yl ester Formula: C25H35BrO3 MolecularWeight: 463.4476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CCC2)Br

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C(=O)OC2=CC=CCC2)Br

InChI

InChI=1S/C25H35BrO3/c1-2-3-4-5-6-7-8-9-10-14-19-28-24-18-17-21(20-23(24)26)25(27)29-22-15-12-11-13-16-22/h11-12,15,17-18,20H,2-10,13-14,16,19H2,1H3