Chemical ID: 6565471

Cc1ccc(c(c1)C)C(=O)OCC(=O)Nc2c(cc(cc2Cl)Cl)Cl
Chemical ID:
6565471
Name [?]:
(2,4,6-trichlorophenyl)carbamoylmethyl 2,4-dimethylbenzoate
SMILES [?]:
Cc1ccc(c(c1)C)C(=O)OCC(=O)Nc2c(cc(cc2Cl)Cl)Cl
InChi [?]:
InChI=1/C17H14Cl3NO3/c1-9-3-4-12(10(2)5-9)17(23)24-8-15(22)21-16-13(19)6-11(18)7-14(16)20/h3-7H,8H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,8,3,4,7,18,20,12,2,6,19,5,17,21,13,16,9,23,24,22,15,14,10,11/E:(6,7)(13,14)(19,20)/rA:24nCCCCCCCCCOOCCONCCCCCCClClCl/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;d9;s9;s11;s12;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14Cl3NO3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.4412
Area:582.787
Solvation:-3.12849
Coulombic:-42.1002
Bond Count [?]
All:25
Single:17
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:386.656
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.44
LogP (Chemaxon):3.86

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