3-(3-chloranyl-6-methoxy-2,4-dimethyl-phenyl)prop-2-ynoic acid

Systemtic Name: 3-(3-chloranyl-6-methoxy-2,4-dimethyl-phenyl)prop-2-ynoic acid Openeye Name: 3-(3-chloro-6-methoxy-2,4-dimethyl-phenyl)prop-2-ynoic acid CAS Name: 3-(3-chloro-6-methoxy-2,4-dimethylphenyl)-2-propynoic acid IUPAC Name: 3-(3-chloro-6-methoxy-2,4-dimethylphenyl)prop-2-ynoic acid Traditional Name: 3-(3-chloro-6-methoxy-2,4-dimethyl-phenyl)propiolic acid Formula: C12H11ClO3 MolecularWeight: 238.66694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)C#CC(=O)O)OC

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)C#CC(=O)O)OC

InChI

InChI=1S/C12H11ClO3/c1-7-6-10(16-3)9(4-5-11(14)15)8(2)12(7)13/h6H,1-3H3,(H,14,15)