4-[6-(4-carboxyphenyl)-1,2,4,5-tetrazin-3-yl]benzoic acid

CAS: 753031-26-4

Formula: C16H10N4O4

SMILES: OC(=O)C1=CC=C(C=C1)C1=NN=C(N=N1)C1=CC=C(C=C1)C(O)=O

IUPAC: 4-[6-(4-carboxyphenyl)-1,2,4,5-tetrazin-3-yl]benzoic acid

InChI: InChI=1S/C16H10N4O4/c21-15(22)11-5-1-9(2-6-11)13-17-19-14(20-18-13)10-3-7-12(8-4-10)16(23)24/h1-8H,(H,21,22)(H,23,24)

Composition: C (59.63%), H (3.13%), N (17.38%), O (19.86%)

Molar Mass: 322.28

Atom Count: 34

Heavy Atom Count: 24