A1HZ7
Summary
Name: | (5~{S})-3-(2-chlorophenyl)-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-8,10-dione |
Formula: | C13 H11 Cl N2 O3 |
Formal charge: | 0 |
Formula weight: | 278.691 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (5~{S})-3-(2-chlorophenyl)-1-oxa-2,9-diazaspiro[4.5]dec-2-ene-8,10-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C13H11ClN2O3/c14-9-4-2-1-3-8(9)10-7-13(19-16-10)6-5-11(17)15-12(13)18/h1-4H,5-7H2,(H,15,17,18)/t13-/m0/s1 |
InChIKey | InChI | 1.06 | BUCCPXBJMQOJMQ-ZDUSSCGKSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccccc1C2=NO[C@@]3(CCC(=O)NC3=O)C2 |
SMILES | CACTVS | 3.385 | Clc1ccccc1C2=NO[C]3(CCC(=O)NC3=O)C2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C2=NO[C@]3(C2)CCC(=O)NC3=O)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)C2=NOC3(C2)CCC(=O)NC3=O)Cl |