Chemical ID: 7047384

CCOc1ccc2cc(c(=O)oc2c1)C(=O)Nc3ccccc3C(F)(F)F
Chemical ID:
7047384
Name [?]:
7-ethoxy-2-oxo-N-[2-(trifluoromethyl)phenyl]-chromene-3-carboxamide
SMILES [?]:
CCOc1ccc2cc(c(=O)oc2c1)C(=O)Nc3ccccc3C(F)(F)F
InChi [?]:
InChI=1/C19H14F3NO4/c1-2-26-12-8-7-11-9-13(18(25)27-16(11)10-12)17(24)23-15-6-4-3-5-14(15)19(20,21)22/h3-10H,2H2,1H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,2,21,20,22,19,6,5,8,14,7,4,9,23,18,13,15,10,24,25,26,27,17,16,11,3,12/E:(20,21,22)/rA:27nCCOCCCCCCCOOCCCONCCCCCCCFFF/rB:s1;s2;s3;s4;d5;s6;s7;d8;s9;d10;s10;d7s12;d4s13;s9;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;s24;s24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H14F3NO4
All Atoms:41
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:8.31722
Area:545.584
Solvation:-5.32239
Coulombic:-65.036
Bond Count [?]
All:29
Single:20
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:377.314
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.93
LogP (Chemaxon):4.14

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Descriptor Annotations

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