Molecule Info: 3-[1'-[(2~{S})-2-(4-chlorophenyl)-3-methyl-butanoyl]spiro[1,3-benzodioxole-2,4'-piperidine]-5-yl]propanoic acid
Smiles:
CC(C)C(C1=CC=C(C=C1)Cl)C(=O)N2CCC3(CC2)OC4=C(O3)C=C(C=C4)CCC(=O)O
InChIKey:
OHAKQPWAEANPAJ-QHCPKHFHSA-N
InChI:
InChI=1S/C25H28ClNO5/c1-16(2)23(18-5-7-19(26)8-6-18)24(30)27-13-11-25(12-14-27)31-20-9-3-17(4-10-22(28)29)15-21(20)32-25/h3,5-9,15-16,23H,4,10-14H2,1-2H3,(H,28,29)/t23-/m0/s1
InChIcol:
1
More information (from its Standard Form):
3-[1'-[(2~{S})-2-(4-chlorophenyl)-3-methyl-butanoyl]spiro[1,3-benzodioxole-2,4'-piperidine]-5-yl]propanoic acid
Complex structures in which this molecule appears :
Complex Structure ID: 587 Complex Structure ID: 720