4-[2-(benzotriazol-1-yl)ethanoyl]piperazin-2-one

Systemtic Name: 4-[2-(benzotriazol-1-yl)ethanoyl]piperazin-2-one Openeye Name: 4-[2-(benzotriazol-1-yl)acetyl]piperazin-2-one CAS Name: 4-[2-(1-benzotriazolyl)-1-oxoethyl]-2-piperazinone IUPAC Name: 4-[2-(benzotriazol-1-yl)acetyl]piperazin-2-one Traditional Name: 4-[2-(benzotriazol-1-yl)acetyl]piperazin-2-one Formula: C12H13N5O2 MolecularWeight: 259.26392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1CN(CC(=O)N1)C(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H13N5O2/c18-11-7-16(6-5-13-11)12(19)8-17-10-4-2-1-3-9(10)14-15-17/h1-4H,5-8H2,(H,13,18)