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Chemical ID: 4556815
Chemical ID:
4556815
Name [?]:
N-hydroxy-4-methoxy-N-phenyl-benzamide
SMILES [?]:
COc1ccc(cc1)C(=O)N(c2ccccc2)O
InChi [?]:
InChI=1/C14H13NO3/c1-18-13-9-7-11(8-10-13)14(16)15(17)12-5-3-2-4-6-12/h2-10,17H,1H3
InChi Info:
AuxInfo=1/0/N:1,15,14,16,13,17,5,7,4,8,6,12,3,9,11,10,18,2/E:(3,4)(5,6)(7,8)(9,10)/rA:18nCOCCCCCCCONCCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s9;s11;s12;d13;s14;d15;d12s16;s11;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H13NO3 |
All Atoms: | 18 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.20945 |
Area: | 418.453 |
Solvation: | -3.25187 |
Coulombic: | -34.9578 |
Bond Count [?]
All: | 19 |
Single: | 12 |
Double: | 7 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 243.258 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 2.36 |
LogP (Chemaxon): | 2.16 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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