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Chemical ID: 7528399
Chemical ID:
7528399
Name [?]:
N-(3,5-dichloro-4-hydroxy-phenyl)-2-ethoxy-benzamide
SMILES [?]:
CCOc1ccccc1C(=O)Nc2cc(c(c(c2)Cl)O)Cl
InChi [?]:
InChI=1/C15H13Cl2NO3/c1-2-21-13-6-4-3-5-10(13)15(20)18-9-7-11(16)14(19)12(17)8-9/h3-8,19H,2H2,1H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,7,6,8,5,14,18,13,9,15,17,4,16,10,21,19,12,20,11,3/E:(7,8)(11,12)(16,17)/rA:21nCCOCCCCCCCONCCCCCCClOCl/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s17;s16;s15;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H13Cl2NO3 |
All Atoms: | 34 |
Heavy Atoms: | 21 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.35292 |
Area: | 512.433 |
Solvation: | -4.45791 |
Coulombic: | -44.8406 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.75 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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