[3-[4-(3-bromanylprop-1-ynyl)phenyl]phenyl] propanoate

Systemtic Name: [3-[4-(3-bromanylprop-1-ynyl)phenyl]phenyl] propanoate Openeye Name: [3-[4-(3-bromoprop-1-ynyl)phenyl]phenyl] propanoate CAS Name: propanoic acid [3-[4-(3-bromoprop-1-ynyl)phenyl]phenyl] ester IUPAC Name: [3-[4-(3-bromoprop-1-ynyl)phenyl]phenyl] propanoate Traditional Name: propionic acid [3-[4-(3-bromoprop-1-ynyl)phenyl]phenyl] ester Formula: C18H15BrO2 MolecularWeight: 343.2145

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC(=C1)C2=CC=C(C=C2)C#CCBr

Isomeric SMILES

CCC(=O)OC1=CC=CC(=C1)C2=CC=C(C=C2)C#CCBr

InChI

InChI=1S/C18H15BrO2/c1-2-18(20)21-17-7-3-6-16(13-17)15-10-8-14(9-11-15)5-4-12-19/h3,6-11,13H,2,12H2,1H3