(S)-[(tert-butoxycarbonyl)amino][2-(trifluoromethyl)phenyl]acetic acid

CAS: 1203454-45-8

Formula: C14H16F3NO4

SMILES: CC(C)(C)OC(=O)N[C@H](C(O)=O)C1=C(C=CC=C1)C(F)(F)F

IUPAC: (2S)-2-{[(tert-butoxy)carbonyl]amino}-2-[2-(trifluoromethyl)phenyl]acetic acid

InChI: InChI=1S/C14H16F3NO4/c1-13(2,3)22-12(21)18-10(11(19)20)8-6-4-5-7-9(8)14(15,16)17/h4-7,10H,1-3H3,(H,18,21)(H,19,20)/t10-/m0/s1

Composition: C (52.67%), H (5.05%), F (17.85%), N (4.39%), O (20.04%)

Molar Mass: 319.28

Atom Count: 38

Heavy Atom Count: 22