3-(piperidin-1-ium-1-ylmethyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(piperidin-1-ium-1-ylmethyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(piperidin-1-ium-1-ylmethyl)-1,2,3-benzotriazin-4-one CAS Name: 3-(1-piperidin-1-iumylmethyl)-1,2,3-benzotriazin-4-one IUPAC Name: 3-(piperidin-1-ium-1-ylmethyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-(piperidin-1-ium-1-ylmethyl)-1,2,3-benzotriazin-4-one Formula: C13H17N4O+ MolecularWeight: 245.30028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

C1CC[NH+](CC1)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H16N4O/c18-13-11-6-2-3-7-12(11)14-15-17(13)10-16-8-4-1-5-9-16/h2-3,6-7H,1,4-5,8-10H2/p+1