phenyl 4-(3-phenoxyprop-1-ynyl)benzoate

Systemtic Name: phenyl 4-(3-phenoxyprop-1-ynyl)benzoate Openeye Name: phenyl 4-(3-phenoxyprop-1-ynyl)benzoate CAS Name: 4-(3-phenoxyprop-1-ynyl)benzoic acid phenyl ester IUPAC Name: phenyl 4-(3-phenoxyprop-1-ynyl)benzoate Traditional Name: 4-(3-phenoxyprop-1-ynyl)benzoic acid phenyl ester Formula: C22H16O3 MolecularWeight: 328.36064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC#CC2=CC=C(C=C2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)OCC#CC2=CC=C(C=C2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C22H16O3/c23-22(25-21-11-5-2-6-12-21)19-15-13-18(14-16-19)8-7-17-24-20-9-3-1-4-10-20/h1-6,9-16H,17H2