Chemical ID: 7353391

Cc1c2ccc(c(c2oc(=O)c1CC(=O)NCc3ccc4c(c3)OCO4)OC)OC
Chemical ID:
7353391
Name [?]:
N-(benzo[1,3]dioxol-5-ylmethyl)-2-(7,8-dimethoxy-4-methyl-2-oxo-chromen-3-yl)-acetamide
SMILES [?]:
Cc1c2ccc(c(c2oc(=O)c1CC(=O)NCc3ccc4c(c3)OCO4)OC)OC
InChi [?]:
InChI=1/C22H21NO7/c1-12-14-5-7-17(26-2)21(27-3)20(14)30-22(25)15(12)9-19(24)23-10-13-4-6-16-18(8-13)29-11-28-16/h4-8H,9-11H2,1-3H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,30,28,19,4,20,5,23,13,17,25,2,18,3,12,21,6,22,14,8,7,10,16,15,11,29,27,26,24,9/rA:30nCCCCCCCCOCOCCCONCCCCCCCOCOOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;d2s10;s12;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s22;s24;s21s25;s7;s27;s6;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H21NO7
All Atoms:51
Heavy Atoms:30
Chiral Atoms:None
ZAP Information [?]
Total:7.43378
Area:625.436
Solvation:-8.20211
Coulombic:-68.9226
Bond Count [?]
All:33
Single:24
Double:9
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.29
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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