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Chemical ID: 7707300
Chemical ID:
7707300
Name [?]:
None
SMILES [?]:
CCc1ccc(cc1)NC(=O)COc2cccc3c2cccc3
InChi [?]:
InChI=1/C20H19NO2/c1-2-15-10-12-17(13-11-15)21-20(22)14-23-19-9-5-7-16-6-3-4-8-18(16)19/h3-13H,2,14H2,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,22,21,16,23,17,20,15,4,8,5,7,12,3,18,6,19,14,10,9,11,13/E:(10,11)(12,13)/rA:23nCCCCCCCCNCOCOCCCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s19;d20;s21;s18d22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H19NO2 |
All Atoms: | 42 |
Heavy Atoms: | 23 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.0535 |
Area: | 524.561 |
Solvation: | -4.06053 |
Coulombic: | -30.6183 |
Bond Count [?]
All: | 25 |
Single: | 16 |
Double: | 9 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.84 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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