tert-butyl 2-azanyl-3-oxidanyl-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoate

Systemtic Name: tert-butyl 2-azanyl-3-oxidanyl-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoate Openeye Name: tert-butyl 2-amino-3-hydroxy-3-[5-(pyrrolidin-1-ylmethyl)-2-thienyl]propanoate CAS Name: 2-amino-3-hydroxy-3-[5-(1-pyrrolidinylmethyl)-2-thiophenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-3-hydroxy-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoate Traditional Name: 2-amino-3-hydroxy-3-[5-(pyrrolidinomethyl)-2-thienyl]propionic acid tert-butyl ester Formula: C16H26N2O3S MolecularWeight: 326.45424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(C1=CC=C(S1)CN2CCCC2)O)N

Isomeric SMILES

CC(C)(C)OC(=O)C(C(C1=CC=C(S1)CN2CCCC2)O)N

InChI

InChI=1S/C16H26N2O3S/c1-16(2,3)21-15(20)13(17)14(19)12-7-6-11(22-12)10-18-8-4-5-9-18/h6-7,13-14,19H,4-5,8-10,17H2,1-3H3