phenyl 4-ethynylbenzoate

Systemtic Name: phenyl 4-ethynylbenzoate Openeye Name: phenyl 4-ethynylbenzoate CAS Name: 4-ethynylbenzoic acid phenyl ester IUPAC Name: phenyl 4-ethynylbenzoate Traditional Name: 4-ethynylbenzoic acid phenyl ester Formula: C15H10O2 MolecularWeight: 222.2387

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

C#CC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C15H10O2/c1-2-12-8-10-13(11-9-12)15(16)17-14-6-4-3-5-7-14/h1,3-11H