Chemical ID: 7351180

COc1ccc(c(c1)OC)c2cc3ccc(cc3oc2=O)OCC(=O)N
Chemical ID:
7351180
Name [?]:
2-[3-(2,4-dimethoxyphenyl)-2-oxo-chromen-7-yl]oxyacetamide
SMILES [?]:
COc1ccc(c(c1)OC)c2cc3ccc(cc3oc2=O)OCC(=O)N
InChi [?]:
InChI=1/C19H17NO6/c1-23-12-5-6-14(17(8-12)24-2)15-7-11-3-4-13(25-10-18(20)21)9-16(11)26-19(15)22/h3-9H,10H2,1-2H3,(H2,20,21)
InChi Info:
AuxInfo=1/1/N:1,10,14,15,4,5,12,8,17,23,13,3,16,6,11,18,7,24,20,26,25,21,2,9,22,19/rA:26nCOCCCCCCOCCCCCCCCCOCOOCCON/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s6;d11;s12;s13;d14;s15;d16;d13s17;s18;s11s19;d20;s16;s22;s23;d24;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17NO6
All Atoms:43
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:5.83708
Area:561.402
Solvation:-8.19797
Coulombic:-64.2477
Bond Count [?]
All:28
Single:19
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:355.341
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.03
LogP (Chemaxon):1.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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