Chemical ID: 4237199

Cc1c(c(=O)c2ccc(cc2o1)OC(=O)c3ccco3)Oc4ccccc4OC
Chemical ID:
4237199
Name [?]:
[3-(2-methoxyphenoxy)-2-methyl-4-oxo-chromen-7-yl] furan-2-carboxylate
SMILES [?]:
Cc1c(c(=O)c2ccc(cc2o1)OC(=O)c3ccco3)Oc4ccccc4OC
InChi [?]:
InChI=1/C22H16O7/c1-13-21(29-17-7-4-3-6-16(17)25-2)20(23)15-10-9-14(12-19(15)27-13)28-22(24)18-8-5-11-26-18/h3-12H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,29,25,24,18,26,23,17,8,7,19,10,2,9,6,27,22,16,11,4,3,14,5,15,28,20,12,13,21/rA:29nCCCCOCCCCCCOOCOCCCCOOCCCCCCOC/rB:s1;d2;s3;d4;s4;s6;d7;s8;d9;d6s10;s2s11;s9;s13;d14;s14;d16;s17;d18;s16s19;s3;s21;s22;d23;s24;d25;d22s26;s27;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H16O7
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:8.58716
Area:591.892
Solvation:-6.21012
Coulombic:-59.3347
Bond Count [?]
All:32
Single:21
Double:11
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:392.358
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.57
LogP (Chemaxon):3.54

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Descriptor Annotations

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