3-(3-oxidanylidene-1,2-diazinan-1-yl)benzoic acid

Systemtic Name: 3-(3-oxidanylidene-1,2-diazinan-1-yl)benzoic acid Openeye Name: 3-(3-oxohexahydropyridazin-1-yl)benzoic acid CAS Name: 3-(3-oxo-1-diazinanyl)benzoic acid IUPAC Name: 3-(3-oxodiazinan-1-yl)benzoic acid Traditional Name: 3-(3-ketohexahydropyridazin-1-yl)benzoic acid Formula: C11H12N2O3 MolecularWeight: 220.22458

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN(C1)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CC(=O)NN(C1)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H12N2O3/c14-10-5-2-6-13(12-10)9-4-1-3-8(7-9)11(15)16/h1,3-4,7H,2,5-6H2,(H,12,14)(H,15,16)