Chemical ID: 7298551

CCOc1ccccc1OCCCC(=O)Nc2ccccc2C(=O)C
Chemical ID:
7298551
Name [?]:
N-(2-acetylphenyl)-4-(2-ethoxyphenoxy)-butanamide
SMILES [?]:
CCOc1ccccc1OCCCC(=O)Nc2ccccc2C(=O)C
InChi [?]:
InChI=1/C20H23NO4/c1-3-24-18-11-6-7-12-19(18)25-14-8-13-20(23)21-17-10-5-4-9-16(17)15(2)22/h4-7,9-12H,3,8,13-14H2,1-2H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,25,2,20,19,6,7,12,21,18,5,8,13,11,23,22,17,4,9,14,16,24,15,3,10/rA:25nCCOCCCCCCOCCCCONCCCCCCCOC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;s22;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H23NO4
All Atoms:48
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:8.24436
Area:587.318
Solvation:-6.4386
Coulombic:-42.2494
Bond Count [?]
All:26
Single:18
Double:8
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:341.401
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.53
LogP (Chemaxon):3.36

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Descriptor Annotations

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