Chemical ID: 7700138

COC(=O)c1ccc(c(c1)NC(=O)C2CCCC2)Cl
Chemical ID:
7700138
Name [?]:
None
SMILES [?]:
COC(=O)c1ccc(c(c1)NC(=O)C2CCCC2)Cl
InChi [?]:
InChI=1/C14H16ClNO3/c1-19-14(18)10-6-7-11(15)12(8-10)16-13(17)9-4-2-3-5-9/h6-9H,2-5H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,16,17,15,18,6,7,10,14,5,8,9,12,3,19,11,13,4,2/E:(2,3)(4,5)/rA:19nCOCOCCCCCCNCOCCCCCCl/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s9;s11;d12;s12;s14;s15;s16;s14s17;s8;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H16ClNO3
All Atoms:35
Heavy Atoms:19
Chiral Atoms:None
ZAP Information [?]
Total:9.33986
Area:471.67
Solvation:-2.45189
Coulombic:-40.9301
Bond Count [?]
All:20
Single:15
Double:5
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.18
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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