3-(3-chlorophenyl)prop-2-ynoic acid

Systemtic Name: 3-(3-chlorophenyl)prop-2-ynoic acid Openeye Name: 3-(3-chlorophenyl)prop-2-ynoic acid CAS Name: 3-(3-chlorophenyl)-2-propynoic acid IUPAC Name: 3-(3-chlorophenyl)prop-2-ynoic acid Traditional Name: 3-(3-chlorophenyl)propiolic acid Formula: C9H5ClO2 MolecularWeight: 180.5878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C#CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C#CC(=O)O

InChI

InChI=1S/C9H5ClO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,(H,11,12)