3-(4-imidazol-1-ylbutyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(4-imidazol-1-ylbutyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(4-imidazol-1-ylbutyl)-1,2,3-benzotriazin-4-one CAS Name: 3-[4-(1-imidazolyl)butyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-(4-imidazol-1-ylbutyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-(4-imidazol-1-ylbutyl)-1,2,3-benzotriazin-4-one Formula: C14H15N5O MolecularWeight: 269.3018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCCN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CCCCN3C=CN=C3

InChI

InChI=1S/C14H15N5O/c20-14-12-5-1-2-6-13(12)16-17-19(14)9-4-3-8-18-10-7-15-11-18/h1-2,5-7,10-11H,3-4,8-9H2