Chemical ID: 6156776

CC(C)(C(=O)Nc1cc(ccc1Cl)[N+](=O)[O-])Oc2ccc(cc2)Cl
Chemical ID:
6156776
Name [?]:
N-(2-chloro-5-nitro-phenyl)-2-(4-chlorophenoxy)-2-methyl-propanamide
SMILES [?]:
CC(C)(C(=O)Nc1cc(ccc1Cl)[N+](=O)[O-])Oc2ccc(cc2)Cl
InChi [?]:
InChI=1/C16H14Cl2N2O4/c1-16(2,24-12-6-3-10(17)4-7-12)15(21)19-14-9-11(20(22)23)5-8-13(14)18/h3-9H,1-2H3,(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,3,20,22,10,19,23,11,8,21,9,18,12,7,4,2,24,13,6,14,5,15,16,17/E:(1,2)(3,4)(6,7)(22,23)/CRV:20.5/rA:24nCCCCONCCCCCCClN+OO-OCCCCCCCl/rB:s1;s2;s2;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s9;d14;s14;s2;s17;s18;d19;s20;d21;d18s22;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14Cl2N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:5.40597
Area:552.775
Solvation:-8.41341
Coulombic:-41.7559
Bond Count [?]
All:25
Single:17
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:369.199
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.32
LogP (Chemaxon):3.96

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