[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-acetamido-2-(hydroxymethyl)butanoate

Systemtic Name: [5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-acetamido-2-(hydroxymethyl)butanoate Openeye Name: [5-(pyrrolidin-1-ylmethyl)-2-thienyl] 2-acetamido-2-(hydroxymethyl)butanoate CAS Name: 2-acetamido-2-(hydroxymethyl)butanoic acid [5-(1-pyrrolidinylmethyl)-2-thiophenyl] ester IUPAC Name: [5-(pyrrolidin-1-ylmethyl)thiophen-2-yl] 2-acetamido-2-(hydroxymethyl)butanoate Traditional Name: 2-acetamido-2-methylol-butyric acid [5-(pyrrolidinomethyl)-2-thienyl] ester Formula: C16H24N2O4S MolecularWeight: 340.43776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)(C(=O)OC1=CC=C(S1)CN2CCCC2)NC(=O)C

Isomeric SMILES

CCC(CO)(C(=O)OC1=CC=C(S1)CN2CCCC2)NC(=O)C

InChI

InChI=1S/C16H24N2O4S/c1-3-16(11-19,17-12(2)20)15(21)22-14-7-6-13(23-14)10-18-8-4-5-9-18/h6-7,19H,3-5,8-11H2,1-2H3,(H,17,20)