Chemical ID: 4409589

CCOc1ccc(cc1Cl)C(=O)Nc2ccc(cc2OC)OC
Chemical ID:
4409589
Name [?]:
3-chloro-N-(2,4-dimethoxyphenyl)-4-ethoxy-benzamide
SMILES [?]:
CCOc1ccc(cc1Cl)C(=O)Nc2ccc(cc2OC)OC
InChi [?]:
InChI=1/C17H18ClNO4/c1-4-23-15-8-5-11(9-13(15)18)17(20)19-14-7-6-12(21-2)10-16(14)22-3/h5-10H,4H2,1-3H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,23,21,2,6,16,15,5,8,18,7,17,9,14,4,19,11,10,13,12,22,20,3/rA:23nCCOCCCCCCClCONCCCCCCOCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s7;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s20;s17;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18ClNO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.54626
Area:544.582
Solvation:-5.06829
Coulombic:-43.982
Bond Count [?]
All:24
Single:17
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:335.782
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.78
LogP (Chemaxon):3.2

Name Annotations

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Descriptor Annotations

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