2-[4-[2-(5-nitroimidazol-1-yl)ethyl]piperazin-1-yl]propanoic acid

Systemtic Name: 2-[4-[2-(5-nitroimidazol-1-yl)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 2-[4-[2-(5-nitroimidazol-1-yl)ethyl]piperazin-1-yl]propanoic acid CAS Name: 2-[4-[2-(5-nitro-1-imidazolyl)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 2-[4-[2-(5-nitroimidazol-1-yl)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 2-[4-[2-(5-nitroimidazol-1-yl)ethyl]piperazino]propionic acid Formula: C12H19N5O4 MolecularWeight: 297.31036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCN(CC1)CCN2C=NC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)N1CCN(CC1)CCN2C=NC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H19N5O4/c1-10(12(18)19)15-5-2-14(3-6-15)4-7-16-9-13-8-11(16)17(20)21/h8-10H,2-7H2,1H3,(H,18,19)