Chemical ID: 7477259

Cc1ccc(cc1C)OCC(=O)Nc2ccc(cc2)[N+](=O)[O-]
Chemical ID:
7477259
Name [?]:
2-(3,4-dimethylphenoxy)-N-(4-nitrophenyl)-acetamide
SMILES [?]:
Cc1ccc(cc1C)OCC(=O)Nc2ccc(cc2)[N+](=O)[O-]
InChi [?]:
InChI=1/C16H16N2O4/c1-11-3-8-15(9-12(11)2)22-10-16(19)17-13-4-6-14(7-5-13)18(20)21/h3-9H,10H2,1-2H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,8,3,15,19,16,18,4,6,10,2,7,14,17,5,11,13,20,12,21,22,9/E:(4,5)(6,7)(20,21)/CRV:18.5/rA:22nCCCCCCCCOCCONCCCCCCN+OO-/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s17;d20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16N2O4
All Atoms:38
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:3.44895
Area:515.745
Solvation:-9.44467
Coulombic:-39.3328
Bond Count [?]
All:23
Single:15
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:300.309
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:3.32
LogP (Chemaxon):3.76

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