(E)-5-(3-methylphenyl)pent-2-en-4-ynoic acid

Systemtic Name: (E)-5-(3-methylphenyl)pent-2-en-4-ynoic acid Openeye Name: (E)-5-(m-tolyl)pent-2-en-4-ynoic acid CAS Name: (E)-5-(3-methylphenyl)pent-2-en-4-ynoic acid IUPAC Name: (E)-5-(3-methylphenyl)pent-2-en-4-ynoic acid Traditional Name: (E)-5-(m-tolyl)pent-2-en-4-ynoic acid Formula: C12H10O2 MolecularWeight: 186.2066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=CC(=C1)C#C/C=C/C(=O)O

InChI

InChI=1S/C12H10O2/c1-10-5-4-7-11(9-10)6-2-3-8-12(13)14/h3-5,7-9H,1H3,(H,13,14)/b8-3+