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Chemical ID: 7722095
Chemical ID:
7722095
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1)OCC(=O)N(Cc2ccccc2)c3ccc(cc3)OC
InChi [?]:
InChI=1/C23H23NO3/c1-18-8-12-22(13-9-18)27-17-23(25)24(16-19-6-4-3-5-7-19)20-10-14-21(26-2)15-11-20/h3-15H,16-17H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,27,17,16,18,15,19,3,7,21,25,4,6,22,24,13,9,2,14,20,23,5,10,12,11,26,8/E:(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)/rA:27nCCCCCCCOCCONCCCCCCCCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s12;s20;d21;s22;d23;d20s24;s23;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C23H23NO3 |
All Atoms: | 50 |
Heavy Atoms: | 27 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 9.17778 |
Area: | 583.372 |
Solvation: | -5.40652 |
Coulombic: | -33.0996 |
Bond Count [?]
All: | 29 |
Single: | 19 |
Double: | 10 |
Rotors: | 8 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.88 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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