ethyl 3-prop-1-ynylbenzoate

Systemtic Name: ethyl 3-prop-1-ynylbenzoate Openeye Name: ethyl 3-prop-1-ynylbenzoate CAS Name: 3-prop-1-ynylbenzoic acid ethyl ester IUPAC Name: ethyl 3-prop-1-ynylbenzoate Traditional Name: 3-prop-1-ynylbenzoic acid ethyl ester Formula: C12H12O2 MolecularWeight: 188.22248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O2/c1-3-6-10-7-5-8-11(9-10)12(13)14-4-2/h5,7-9H,4H2,1-2H3