Chemical ID: 7530215

Cc1c(cccc1NC(=O)c2ccc(c(c2)Cl)Cl)C(=O)OC
Chemical ID:
7530215
Name [?]:
methyl 3-(3,4-dichlorobenzoyl)amino-2-methyl-benzoate
SMILES [?]:
Cc1c(cccc1NC(=O)c2ccc(c(c2)Cl)Cl)C(=O)OC
InChi [?]:
InChI=1/C16H13Cl2NO3/c1-9-11(16(21)22-2)4-3-5-14(9)19-15(20)10-6-7-12(17)13(18)8-10/h3-8H,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,22,5,4,6,12,13,16,2,11,3,14,15,7,9,19,18,17,8,10,20,21/rA:22nCCCCCCCNCOCCCCCCClClCOOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s15;s14;s3;d19;s19;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H13Cl2NO3
All Atoms:35
Heavy Atoms:22
Chiral Atoms:None
ZAP Information [?]
Total:10.5786
Area:526.725
Solvation:-2.58947
Coulombic:-42.7084
Bond Count [?]
All:23
Single:15
Double:8
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.4
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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