3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(3-thienylmethyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(3-thiophenylmethyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(3-thenyl)piperazino]propionic acid Formula: C12H18N2O2S MolecularWeight: 254.34852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)CC2=CSC=C2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)CC2=CSC=C2

InChI

InChI=1S/C12H18N2O2S/c15-12(16)1-3-13-4-6-14(7-5-13)9-11-2-8-17-10-11/h2,8,10H,1,3-7,9H2,(H,15,16)