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Chemical ID: 7047298
Chemical ID:
7047298
Name [?]:
7-methoxy-N-(2-methoxyethyl)-2-oxo-chromene-3-carboxamide
SMILES [?]:
COCCNC(=O)c1cc2ccc(cc2oc1=O)OC
InChi [?]:
InChI=1/C14H15NO5/c1-18-6-5-15-13(16)11-7-9-3-4-10(19-2)8-12(9)20-14(11)17/h3-4,7-8H,5-6H2,1-2H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,20,11,12,4,3,9,14,10,13,8,15,6,17,5,7,18,2,19,16/rA:20nCOCCNCOCCCCCCCCOCOOC/rB:s1;s2;s3;s4;s5;d6;s6;d8;s9;s10;d11;s12;d13;d10s14;s15;s8s16;d17;s13;s19;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H15NO5 |
All Atoms: | 35 |
Heavy Atoms: | 20 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 5.49014 |
Area: | 474.268 |
Solvation: | -6.36655 |
Coulombic: | -53.0807 |
Bond Count [?]
All: | 21 |
Single: | 15 |
Double: | 6 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 277.273 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 0.82 |
LogP (Chemaxon): | 0.59 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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