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Chemical ID: 7298557
Chemical ID:
7298557
Name [?]:
2-(4-acetyl-2-methoxy-phenoxy)-N-(2-acetylphenyl)-acetamide
SMILES [?]:
CC(=O)c1ccc(c(c1)OC)OCC(=O)Nc2ccccc2C(=O)C
InChi [?]:
InChI=1/C19H19NO5/c1-12(21)14-8-9-17(18(10-14)24-3)25-11-19(23)20-16-7-5-4-6-15(16)13(2)22/h4-10H,11H2,1-3H3,(H,20,23)
InChi Info:
AuxInfo=1/1/N:1,25,11,20,19,21,18,5,6,9,13,2,23,4,22,17,7,8,14,16,3,24,15,10,12/rA:25nCCOCCCCCCOCOCCONCCCCCCCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s8;s10;s7;s12;s13;d14;s14;s16;s17;d18;s19;d20;d17s21;s22;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H19NO5 |
All Atoms: | 44 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.08114 |
Area: | 561.547 |
Solvation: | -7.95755 |
Coulombic: | -48.6848 |
Bond Count [?]
All: | 26 |
Single: | 17 |
Double: | 9 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 341.358 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 6 |
XLogP: | 2.43 |
LogP (Chemaxon): | 1.89 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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