[(Z,6R)-17-methoxy-17-oxidanylidene-heptadec-4-en-6-yl] 4-bromanylbenzoate

Systemtic Name: [(Z,6R)-17-methoxy-17-oxidanylidene-heptadec-4-en-6-yl] 4-bromanylbenzoate Openeye Name: [(1R)-12-methoxy-12-oxo-1-[(Z)-pent-1-enyl]dodecyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(Z,6R)-17-methoxy-17-oxoheptadec-4-en-6-yl] ester IUPAC Name: [(Z,6R)-17-methoxy-17-oxoheptadec-4-en-6-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(Z,1R)-1-(11-keto-11-methoxy-undecyl)hex-2-enyl] ester Formula: C25H37BrO4 MolecularWeight: 481.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC(CCCCCCCCCCC(=O)OC)OC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCC/C=C\[C@@H](CCCCCCCCCCC(=O)OC)OC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C25H37BrO4/c1-3-4-11-14-23(30-25(28)21-17-19-22(26)20-18-21)15-12-9-7-5-6-8-10-13-16-24(27)29-2/h11,14,17-20,23H,3-10,12-13,15-16H2,1-2H3/b14-11-/t23-/m0/s1