3-[(tert-butoxycarbonyl)amino]-2-cyanobenzoic acid

CAS: 1397243-57-0

Formula: C13H14N2O4

SMILES: CC(C)(C)OC(=O)NC1=C(C#N)C(=CC=C1)C(O)=O

IUPAC: 3-{[(tert-butoxy)carbonyl]amino}-2-cyanobenzoic acid

InChI: InChI=1S/C13H14N2O4/c1-13(2,3)19-12(18)15-10-6-4-5-8(11(16)17)9(10)7-14/h4-6H,1-3H3,(H,15,18)(H,16,17)

Composition: C (59.54%), H (5.38%), N (10.68%), O (24.40%)

Molar Mass: 262.265

Atom Count: 33

Heavy Atom Count: 19