hex-4-yn-3-yl 2-chloranylbenzoate

Systemtic Name: hex-4-yn-3-yl 2-chloranylbenzoate Openeye Name: 1-ethylbut-2-ynyl 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid hex-4-yn-3-yl ester IUPAC Name: hex-4-yn-3-yl 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid 1-ethylbut-2-ynyl ester Formula: C13H13ClO2 MolecularWeight: 236.69412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC)OC(=O)C1=CC=CC=C1Cl

Isomeric SMILES

CCC(C#CC)OC(=O)C1=CC=CC=C1Cl

InChI

InChI=1S/C13H13ClO2/c1-3-7-10(4-2)16-13(15)11-8-5-6-9-12(11)14/h5-6,8-10H,4H2,1-2H3