Chemical ID: 7295217

CC(C)(C)N(Cc1ccccc1)C(=O)COc2ccccc2[N+](=O)[O-]
Chemical ID:
7295217
Name [?]:
N-benzyl-2-(2-nitrophenoxy)-N-tert-butyl-acetamide
SMILES [?]:
CC(C)(C)N(Cc1ccccc1)C(=O)COc2ccccc2[N+](=O)[O-]
InChi [?]:
InChI=1/C19H22N2O4/c1-19(2,3)20(13-15-9-5-4-6-10-15)18(22)14-25-17-12-8-7-11-16(17)21(23)24/h4-12H,13-14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,10,9,11,20,19,8,12,21,18,6,15,7,22,17,13,2,5,23,14,24,25,16/E:(1,2,3)(5,6)(9,10)(23,24)/CRV:21.5/rA:25nCCCCNCCCCCCCCOCOCCCCCCN+OO-/rB:s1;s2;s2;s2;s5;s6;s7;d8;s9;d10;d7s11;s5;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s22;d23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H22N2O4
All Atoms:47
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:1.53462
Area:533.592
Solvation:-11.8052
Coulombic:-34.7214
Bond Count [?]
All:26
Single:18
Double:8
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:342.389
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.03
LogP (Chemaxon):3.53

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