The Biofilms Structural Database |
Chlorolactone |
|
---|---|
3QP5 |
|
Code
HLC | |
Name |
4-(4-chlorophenoxy)-N-[(3S)-2-oxotetrahydrofuran-3-yl]butanamide |
Molecular Weight |
297.73 |
Isomeric SMILES |
Clc1ccc(OCCCC(=O)N[C@H]2CCOC2=O)cc1 |
Formula |
C14H16ClNO4 |
Identifiers |
4-(4-chlorophenoxy)-N-[(3S)-2-oxooxolan-3-yl]butanamide |
Formal Charge |
0 |
InChI |
InChI=1S/C14H16ClNO4/c15-10-3-5-11(6-4-10)19-8-1-2-13(17)16-12-7-9-20-14(12)18/h3-6,12H,1-2,7-9H2,(H,16,17)/t12-/m0/s1 |
Atom Count |
36 |
InChIKey |
BKVYYPQMGSVOHB-LBPRGKRZSA-N |
PDB codes |
3QP5 |
Type |
Non-polymer |
Chiral Atom Count |
1 |
Chiral Atoms |
C4 |
Bond Count |
37 |
Aromatic Bond Count |
6 |
Leaving Atoms |
n/a |