Catalog Number:
AG01B8VZ
Chemical Name:
2-benzyl-octahydro-1H-isoindole-3a-carboxylic acid
CAS Number:
1807938-26-6
Molecular Formula:
C16H21NO2
Molecular Weight:
259.3434
MDL Number:
MFCD29912970
IUPAC Name:
(3aS,7aS)-2-benzyl-3,4,5,6,7,7a-hexahydro-1H-isoindole-3a-carboxylic acid
InChI:
InChI=1S/C16H21NO2/c18-15(19)16-9-5-4-8-14(16)11-17(12-16)10-13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2,(H,18,19)/t14-,16-/m1/s1
InChI Key:
CZQSVBQTEURCPD-GDBMZVCRSA-N
SMILES:
OC(=O)[C@]12CCCC[C@@H]2CN(C1)Cc1ccccc1
