Chemical ID: 7343353

CC1C(=Cc2ccccc2O1)C=C3C(=O)c4ccc(cc4O3)OC(=O)c5ccco5
Chemical ID:
7343353
Name [?]:
[2-[(2-methyl-2H-chromen-3-yl)methylene]-3-oxo-benzofuran-6-yl] furan-2-carboxylate
SMILES [?]:
CC1C(=Cc2ccccc2O1)C=C3C(=O)c4ccc(cc4O3)OC(=O)c5ccco5
InChi [?]:
InChI=1/C24H16O6/c1-14-16(11-15-5-2-3-6-19(15)28-14)12-22-23(25)18-9-8-17(13-21(18)30-22)29-24(26)20-7-4-10-27-20/h2-14H,1H3
InChi Info:
AuxInfo=1/0/N:1,7,8,28,6,9,27,18,17,29,4,12,20,2,5,3,19,16,10,26,21,13,14,24,15,25,30,11,23,22/rA:30cCCCCCCCCCCOCCCOCCCCCCOOCOCCCCO/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;s2s10;s3;w12;s13;d14;s14;s16;d17;s18;d19;d16s20;s13s21;s19;s23;d24;s24;d26;s27;d28;s26s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H16O6
All Atoms:46
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:9.95493
Area:599.998
Solvation:-5.04503
Coulombic:-53.6522
Bond Count [?]
All:34
Single:22
Double:12
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:400.38
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.15
LogP (Chemaxon):3.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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