Chemical ID: 7503930

CCN(c1ccccc1)C(=O)c2cccc(c2)OCC
Chemical ID:
7503930
Name [?]:
3-ethoxy-N-ethyl-N-phenyl-benzamide
SMILES [?]:
CCN(c1ccccc1)C(=O)c2cccc(c2)OCC
InChi [?]:
InChI=1/C17H19NO2/c1-3-18(15-10-6-5-7-11-15)17(19)14-9-8-12-16(13-14)20-4-2/h5-13H,3-4H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,2,19,7,6,8,14,13,5,9,15,17,12,4,16,10,3,11,18/E:(6,7)(10,11)/rA:20nCCNCCCCCCCOCCCCCCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s3;d10;s10;s12;d13;s14;d15;d12s16;s16;s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19NO2
All Atoms:39
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.6272
Area:464.952
Solvation:-2.9966
Coulombic:-26.3106
Bond Count [?]
All:21
Single:14
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.338
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.9
LogP (Chemaxon):3.3

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Descriptor Annotations

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