ethyl 2-acetamido-3-(5-non-1-ynylthiophen-2-yl)-3-oxidanyl-propanoate

Systemtic Name: ethyl 2-acetamido-3-(5-non-1-ynylthiophen-2-yl)-3-oxidanyl-propanoate Openeye Name: ethyl 2-acetamido-3-hydroxy-3-(5-non-1-ynyl-2-thienyl)propanoate CAS Name: 2-acetamido-3-hydroxy-3-(5-non-1-ynyl-2-thiophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-acetamido-3-hydroxy-3-(5-non-1-ynylthiophen-2-yl)propanoate Traditional Name: 2-acetamido-3-hydroxy-3-(5-non-1-ynyl-2-thienyl)propionic acid ethyl ester Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC#CC1=CC=C(S1)C(C(C(=O)OCC)NC(=O)C)O

Isomeric SMILES

CCCCCCCC#CC1=CC=C(S1)C(C(C(=O)OCC)NC(=O)C)O

InChI

InChI=1S/C20H29NO4S/c1-4-6-7-8-9-10-11-12-16-13-14-17(26-16)19(23)18(21-15(3)22)20(24)25-5-2/h13-14,18-19,23H,4-10H2,1-3H3,(H,21,22)