2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(1-oxo-3-phenylprop-2-ynyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-phenylprop-2-ynoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-phenylpropioloyl)piperazino]acetic acid Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C#CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C#CC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3/c18-14(7-6-13-4-2-1-3-5-13)17-10-8-16(9-11-17)12-15(19)20/h1-5H,8-12H2,(H,19,20)