Chemical ID: 7492808

CCOC(=O)c1ccc(cc1)NC(=O)c2ccccc2OCc3ccccc3
Chemical ID:
7492808
Name [?]:
ethyl 4-(2-benzyloxybenzoyl)aminobenzoate
SMILES [?]:
CCOC(=O)c1ccc(cc1)NC(=O)c2ccccc2OCc3ccccc3
InChi [?]:
InChI=1/C23H21NO4/c1-2-27-23(26)18-12-14-19(15-13-18)24-22(25)20-10-6-7-11-21(20)28-16-17-8-4-3-5-9-17/h3-15H,2,16H2,1H3,(H,24,25)
InChi Info:
AuxInfo=1/1/N:1,2,26,25,27,17,18,24,28,16,19,7,11,8,10,22,23,6,9,15,20,13,4,12,14,5,3,21/E:(4,5)(8,9)(12,13)(14,15)/rA:28nCCOCOCCCCCCNCOCCCCCCOCCCCCCC/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s9;s12;d13;s13;s15;d16;s17;d18;d15s19;s20;s21;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H21NO4
All Atoms:49
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:10.6682
Area:625.529
Solvation:-4.97002
Coulombic:-50.3566
Bond Count [?]
All:30
Single:19
Double:11
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:375.417
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.98
LogP (Chemaxon):4.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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