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(3S)-3-(4-methoxyphenyl)-4-oxo-3-propan-2-yldiazetidine-1,2-dicarboxylic acid dimethyl ester

PropertiesImage
MNX_IDMNXM172251 Image of MNXM172251
referencechebi:92450
formulaC16H20N2O6
global charge0
mol weight336.344
InChIKeyMFCNPPLTGGUOKM-INIZCTEOSA-N
InChIInChI=1S/C16H20N2O6/c1-10(2)16(11-6-8-12(22-3)9-7-11)13(19)17(14(20)23-4)18(16)15(21)24-5/h6-10H,1-5H3/t16-/m0/s1
SMILESCOC(=O)N1C(=O)[C@@](C2=CC=C(OC)C=C2)(C(C)C)N1C(=O)OC
MNX internals
InChI (mnx)InChI=1/C16H20N2O6/c1-10(2)16(11-6-8-12(22-3)9-7-11)13(19)17(14(20)23-4)18(16)15(21)24-5/h6-10H,1-5H3/t16-/m0/s1 Image of MNXM172251
SMILES (mnx)[CH3:1][CH:10]([CH3:2])[C@:16]1([C:11]2=[CH:7][CH:9]=[C:12]([O:22][CH3:3])[CH:8]=[CH:6]2)[C:13](=[O:19])[N:17]([C:14](=[O:20])[O:23][CH3:4])[N:18]1[C:15](=[O:21])[O:24][CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:92450
chebi:92450
MFCNPPLTGGUOKM-INIZCTEOSA-N
(3S)-3-(4-methoxyphenyl)-4-oxo-3-propan-2-yldiazetidine-1,2-dicarboxylic acid dimethyl ester