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Chemical ID: 7696359
Chemical ID:
7696359
Name [?]:
None
SMILES [?]:
CC(C)Cc1ccc(cc1)C(C)C(=O)NC2CCCCC2
InChi [?]:
InChI=1/C19H29NO/c1-14(2)13-16-9-11-17(12-10-16)15(3)19(21)20-18-7-5-4-6-8-18/h9-12,14-15,18H,4-8,13H2,1-3H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,3,12,19,18,20,17,21,6,10,7,9,4,2,11,5,8,16,13,15,14/E:(1,2)(5,6)(7,8)(9,10)(11,12)/rA:21cCCCCCCCCCCCCCONCCCCCC/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;s11;d13;s13;s15;s16;s17;s18;s19;s16s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H29NO |
All Atoms: | 50 |
Heavy Atoms: | 21 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.0314 |
Area: | 516.311 |
Solvation: | -1.87634 |
Coulombic: | -23.8693 |
Bond Count [?]
All: | 22 |
Single: | 18 |
Double: | 4 |
Rotors: | 6 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.26 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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