4-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoyl]piperazine-1-carbaldehyde Openeye Name: 4-[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]piperazine-1-carbaldehyde CAS Name: 4-[1-oxo-2-(4-oxo-1,2,3-benzotriazin-3-yl)ethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]piperazine-1-carbaldehyde Traditional Name: 4-[2-(4-keto-1,2,3-benzotriazin-3-yl)acetyl]piperazine-1-carbaldehyde Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1CN(CCN1C=O)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H15N5O3/c20-10-17-5-7-18(8-6-17)13(21)9-19-14(22)11-3-1-2-4-12(11)15-16-19/h1-4,10H,5-9H2