ethynyl 3-methylbenzoate

Systemtic Name: ethynyl 3-methylbenzoate Openeye Name: ethynyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid ethynyl ester IUPAC Name: ethynyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid ethynyl ester Formula: C10H8O2 MolecularWeight: 160.16932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H8O2/c1-3-12-10(11)9-6-4-5-8(2)7-9/h1,4-7H,2H3