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

Systemtic Name: tert-butyl 2-azanyl-3-[3-methyl-5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-3-oxidanyl-propanoate Openeye Name: tert-butyl 2-amino-3-hydroxy-3-[3-methyl-5-(pyrrolidin-1-ylmethyl)-2-thienyl]propanoate CAS Name: 2-amino-3-hydroxy-3-[3-methyl-5-(1-pyrrolidinylmethyl)-2-thiophenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-3-hydroxy-3-[3-methyl-5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoate Traditional Name: 2-amino-3-hydroxy-3-[3-methyl-5-(pyrrolidinomethyl)-2-thienyl]propionic acid tert-butyl ester Formula: C17H28N2O3S MolecularWeight: 340.48082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)CN2CCCC2)C(C(C(=O)OC(C)(C)C)N)O

Isomeric SMILES

CC1=C(SC(=C1)CN2CCCC2)C(C(C(=O)OC(C)(C)C)N)O

InChI

InChI=1S/C17H28N2O3S/c1-11-9-12(10-19-7-5-6-8-19)23-15(11)14(20)13(18)16(21)22-17(2,3)4/h9,13-14,20H,5-8,10,18H2,1-4H3