7-methyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid

Systemtic Name: 7-methyl-5-oxidanidyl-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid Openeye Name: 7-methyl-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid CAS Name: 7-methyl-5-oxido-3-pyrazolo[5,1-c][1,2,4]benzotriazin-5-iumcarboxylic acid IUPAC Name: 7-methyl-5-oxidopyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid Traditional Name: 7-methyl-5-oxido-pyrazolo[5,1-c][1,2,4]benzotriazin-5-ium-3-carboxylic acid Formula: C11H8N4O3 MolecularWeight: 244.20622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N3C(=C(C=N3)C(=O)O)N=[N+]2[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N3C(=C(C=N3)C(=O)O)N=[N+]2[O-]

InChI

InChI=1S/C11H8N4O3/c1-6-2-3-8-9(4-6)15(18)13-10-7(11(16)17)5-12-14(8)10/h2-5H,1H3,(H,16,17)