3-[4-[(E)-2-methylpent-2-enoyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[(E)-2-methylpent-2-enoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[(E)-2-methylpent-2-enoyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[(E)-2-methyl-1-oxopent-2-enyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[(E)-2-methylpent-2-enoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[(E)-2-methylpent-2-enoyl]piperazino]propionic acid Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C)C(=O)N1CCN(CC1)CCC(=O)O

Isomeric SMILES

CC/C=C(\C)/C(=O)N1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C13H22N2O3/c1-3-4-11(2)13(18)15-9-7-14(8-10-15)6-5-12(16)17/h4H,3,5-10H2,1-2H3,(H,16,17)/b11-4+