Catalog Number:
AG0047KR
Chemical Name:
2-(4-Boc-piperazinyl)-2-(3-cyano-phenyl)acetic acid
CAS Number:
885274-33-9
Molecular Formula:
C18H23N3O4
Molecular Weight:
345.3929
MDL Number:
MFCD06659348
IUPAC Name:
2-(3-cyanophenyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]acetic acid
InChI:
InChI=1S/C18H23N3O4/c1-18(2,3)25-17(24)21-9-7-20(8-10-21)15(16(22)23)14-6-4-5-13(11-14)12-19/h4-6,11,15H,7-10H2,1-3H3,(H,22,23)
InChI Key:
RPXHJMPXOXMYHN-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C(N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
