Chemical ID: 4147745

CCCCOC(=O)c1ccc(cc1)NC(=O)c2c(cccc2OC)OC
Chemical ID:
4147745
Name [?]:
butyl 4-(2,6-dimethoxybenzoyl)aminobenzoate
SMILES [?]:
CCCCOC(=O)c1ccc(cc1)NC(=O)c2c(cccc2OC)OC
InChi [?]:
InChI=1/C20H23NO5/c1-4-5-13-26-20(23)14-9-11-15(12-10-14)21-19(22)18-16(24-2)7-6-8-17(18)25-3/h6-12H,4-5,13H2,1-3H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,24,26,2,3,20,21,19,9,13,10,12,4,8,11,22,18,17,15,6,14,16,7,23,25,5/E:(2,3)(7,8)(9,10)(11,12)(16,17)(24,25)/rA:26nCCCCOCOCCCCCCNCOCCCCCCOCOC/rB:s1;s2;s3;s4;s5;d6;s6;s8;d9;s10;d11;d8s12;s11;s14;d15;s15;s17;d18;s19;d20;d17s21;s22;s23;s18;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H23NO5
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.70638
Area:607.473
Solvation:-5.48044
Coulombic:-56.4654
Bond Count [?]
All:27
Single:19
Double:8
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:357.4
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.11
LogP (Chemaxon):3.35

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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