2-[4-(3-methylbut-2-enoyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-methylbut-2-enoyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-methylbut-2-enoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(3-methyl-1-oxobut-2-enyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-methylbut-2-enoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-methylbut-2-enoyl)piperazino]acetic acid Formula: C11H18N2O3 MolecularWeight: 226.27222

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)CC(=O)O)C

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)CC(=O)O)C

InChI

InChI=1S/C11H18N2O3/c1-9(2)7-10(14)13-5-3-12(4-6-13)8-11(15)16/h7H,3-6,8H2,1-2H3,(H,15,16)