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Chemical ID: 7297035
Chemical ID:
7297035
Name [?]:
2-(4-acetylphenoxy)-N-[(2-methoxyphenyl)methyl]acetamide
SMILES [?]:
CC(=O)c1ccc(cc1)OCC(=O)NCc2ccccc2OC
InChi [?]:
InChI=1/C18H19NO4/c1-13(20)14-7-9-16(10-8-14)23-12-18(21)19-11-15-5-3-4-6-17(15)22-2/h3-10H,11-12H2,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,23,18,19,17,20,5,9,6,8,15,11,2,4,16,7,21,12,14,3,13,22,10/E:(7,8)(9,10)/rA:23nCCOCCCCCCOCCONCCCCCCCOC/rB:s1;d2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;d12;s12;s14;s15;s16;d17;s18;d19;d16s20;s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H19NO4 |
All Atoms: | 42 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.39596 |
Area: | 549.026 |
Solvation: | -6.32968 |
Coulombic: | -43.4831 |
Bond Count [?]
All: | 24 |
Single: | 16 |
Double: | 8 |
Rotors: | 8 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 313.348 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.57 |
LogP (Chemaxon): | 1.55 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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