3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one CAS Name: 3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one IUPAC Name: 3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-(1,4-diazepan-1-ylmethyl)-1,2,3-benzotriazin-4-one Formula: C13H17N5O MolecularWeight: 259.30698

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1CNCCN(C1)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H17N5O/c19-13-11-4-1-2-5-12(11)15-16-18(13)10-17-8-3-6-14-7-9-17/h1-2,4-5,14H,3,6-10H2