butyl 2-acetamido-2-[5-(3-oxidanylprop-1-ynyl)thiophen-2-yl]propanoate

Systemtic Name: butyl 2-acetamido-2-[5-(3-oxidanylprop-1-ynyl)thiophen-2-yl]propanoate Openeye Name: butyl 2-acetamido-2-[5-(3-hydroxyprop-1-ynyl)-2-thienyl]propanoate CAS Name: 2-acetamido-2-[5-(3-hydroxyprop-1-ynyl)-2-thiophenyl]propanoic acid butyl ester IUPAC Name: butyl 2-acetamido-2-[5-(3-hydroxyprop-1-ynyl)thiophen-2-yl]propanoate Traditional Name: 2-acetamido-2-[5-(3-hydroxyprop-1-ynyl)-2-thienyl]propionic acid butyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C1=CC=C(S1)C#CCO)NC(=O)C

Isomeric SMILES

CCCCOC(=O)C(C)(C1=CC=C(S1)C#CCO)NC(=O)C

InChI

InChI=1S/C16H21NO4S/c1-4-5-11-21-15(20)16(3,17-12(2)19)14-9-8-13(22-14)7-6-10-18/h8-9,18H,4-5,10-11H2,1-3H3,(H,17,19)