3-(5-ethanoylthiophen-2-yl)prop-2-ynyl benzoate

Systemtic Name: 3-(5-ethanoylthiophen-2-yl)prop-2-ynyl benzoate Openeye Name: 3-(5-acetyl-2-thienyl)prop-2-ynyl benzoate CAS Name: benzoic acid 3-(5-acetyl-2-thiophenyl)prop-2-ynyl ester IUPAC Name: 3-(5-acetylthiophen-2-yl)prop-2-ynyl benzoate Traditional Name: benzoic acid 3-(5-acetyl-2-thienyl)prop-2-ynyl ester Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C#CCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC=C(S1)C#CCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H12O3S/c1-12(17)15-10-9-14(20-15)8-5-11-19-16(18)13-6-3-2-4-7-13/h2-4,6-7,9-10H,11H2,1H3