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(2S,3S,4S)-4-(hydroxymethyl)-1-[1-oxo-3-(1-piperidinyl)propyl]-3-phenyl-2-azetidinecarbonitrile

PropertiesImage
MNX_IDMNXM171798 Image of MNXM171798
referencechebi:100882
formulaC19H25N3O2
global charge0
mol weight327.428
InChIKeyDNWBFORDJWKZCR-LMMKCTJWSA-N
InChIInChI=1S/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m1/s1
SMILESN#C[C@@H]1[C@H](C2=CC=CC=C2)[C@@H](CO)N1C(=O)CCN1CCCCC1
MNX internals
InChI (mnx)InChI=1/C19H25N3O2/c20-13-16-19(15-7-3-1-4-8-15)17(14-23)22(16)18(24)9-12-21-10-5-2-6-11-21/h1,3-4,7-8,16-17,19,23H,2,5-6,9-12,14H2/t16-,17-,19+/m1/s1 Image of MNXM171798
SMILES (mnx)[CH:1]1=[CH:3][CH:7]=[C:15]([C@H:19]2[C@@H:16]([C:13]#[N:20])[N:22]([C:18]([CH2:9][CH2:12][N:21]3[CH2:10][CH2:5][CH2:2][CH2:6][CH2:11]3)=[O:24])[C@@H:17]2[CH2:14][OH:23])[CH:8]=[CH:4]1
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:100882
chebi:100882
DNWBFORDJWKZCR-LMMKCTJWSA-N
(2S,3S,4S)-4-(hydroxymethyl)-1-[1-oxo-3-(1-piperidinyl)propyl]-3-phenyl-2-azetidinecarbonitrile