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Chemical ID: 7256605
Chemical ID:
7256605
Name [?]:
2-(3-acetylphenoxy)-N-(2-acetylphenyl)-acetamide
SMILES [?]:
CC(=O)c1cccc(c1)OCC(=O)Nc2ccccc2C(=O)C
InChi [?]:
InChI=1/C18H17NO4/c1-12(20)14-6-5-7-15(10-14)23-11-18(22)19-17-9-4-3-8-16(17)13(2)21/h3-10H,11H2,1-2H3,(H,19,22)
InChi Info:
AuxInfo=1/1/N:1,23,18,17,6,5,7,19,16,9,11,2,21,4,8,20,15,12,14,3,22,13,10/rA:23nCCOCCCCCCOCCONCCCCCCCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s8;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H17NO4 |
All Atoms: | 40 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.39173 |
Area: | 529.44 |
Solvation: | -5.84427 |
Coulombic: | -42.7322 |
Bond Count [?]
All: | 24 |
Single: | 15 |
Double: | 9 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 311.332 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.78 |
LogP (Chemaxon): | 2.14 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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