2-azanyl-3-oxidanyl-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoic acid

Systemtic Name: 2-azanyl-3-oxidanyl-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoic acid Openeye Name: 2-amino-3-hydroxy-3-[5-(pyrrolidin-1-ylmethyl)-2-thienyl]propanoic acid CAS Name: 2-amino-3-hydroxy-3-[5-(1-pyrrolidinylmethyl)-2-thiophenyl]propanoic acid IUPAC Name: 2-amino-3-hydroxy-3-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]propanoic acid Traditional Name: 2-amino-3-hydroxy-3-[5-(pyrrolidinomethyl)-2-thienyl]propionic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(S2)C(C(C(=O)O)N)O

Isomeric SMILES

C1CCN(C1)CC2=CC=C(S2)C(C(C(=O)O)N)O

InChI

InChI=1S/C12H18N2O3S/c13-10(12(16)17)11(15)9-4-3-8(18-9)7-14-5-1-2-6-14/h3-4,10-11,15H,1-2,5-7,13H2,(H,16,17)