6-chloranyl-3-(6-imidazol-1-ylhexyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 6-chloranyl-3-(6-imidazol-1-ylhexyl)-1,2,3-benzotriazin-4-one Openeye Name: 6-chloro-3-(6-imidazol-1-ylhexyl)-1,2,3-benzotriazin-4-one CAS Name: 6-chloro-3-[6-(1-imidazolyl)hexyl]-1,2,3-benzotriazin-4-one IUPAC Name: 6-chloro-3-(6-imidazol-1-ylhexyl)-1,2,3-benzotriazin-4-one Traditional Name: 6-chloro-3-(6-imidazol-1-ylhexyl)-1,2,3-benzotriazin-4-one Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=O)N(N=N2)CCCCCCN3C=CN=C3

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=O)N(N=N2)CCCCCCN3C=CN=C3

InChI

InChI=1S/C16H18ClN5O/c17-13-5-6-15-14(11-13)16(23)22(20-19-15)9-4-2-1-3-8-21-10-7-18-12-21/h5-7,10-12H,1-4,8-9H2