Chemical ID: 6496141

Cc1ccccc1OCC(=O)Nc2ccc(cc2OC)[N+](=O)[O-]
Chemical ID:
6496141
Name [?]:
N-(2-methoxy-4-nitro-phenyl)-2-(2-methylphenoxy)-acetamide
SMILES [?]:
Cc1ccccc1OCC(=O)Nc2ccc(cc2OC)[N+](=O)[O-]
InChi [?]:
InChI=1/C16H16N2O5/c1-11-5-3-4-6-14(11)23-10-16(19)17-13-8-7-12(18(20)21)9-15(13)22-2/h3-9H,10H2,1-2H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,20,4,5,3,6,15,14,17,9,2,16,13,7,18,10,12,21,11,22,23,19,8/E:(20,21)/CRV:18.5/rA:23nCCCCCCCOCCONCCCCCCOCN+OO-/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s19;s16;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H16N2O5
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:3.62973
Area:526.666
Solvation:-9.53691
Coulombic:-46.9548
Bond Count [?]
All:24
Single:16
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:316.309
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.59
LogP (Chemaxon):3.04

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Descriptor Annotations

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