4-[5-(3-oxidanylprop-1-ynyl)thiophen-2-yl]butyl 2-acetamidopropanoate

Systemtic Name: 4-[5-(3-oxidanylprop-1-ynyl)thiophen-2-yl]butyl 2-acetamidopropanoate Openeye Name: 4-[5-(3-hydroxyprop-1-ynyl)-2-thienyl]butyl 2-acetamidopropanoate CAS Name: 2-acetamidopropanoic acid 4-[5-(3-hydroxyprop-1-ynyl)-2-thiophenyl]butyl ester IUPAC Name: 4-[5-(3-hydroxyprop-1-ynyl)thiophen-2-yl]butyl 2-acetamidopropanoate Traditional Name: 2-acetamidopropionic acid 4-[5-(3-hydroxyprop-1-ynyl)-2-thienyl]butyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCCCC1=CC=C(S1)C#CCO)NC(=O)C

Isomeric SMILES

CC(C(=O)OCCCCC1=CC=C(S1)C#CCO)NC(=O)C

InChI

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