Chemical ID: 4521493

c1cc2c(ccc3c2nno3)c(c1)S(=O)(=O)[O-]
Chemical ID:
4521493
Name [?]:
None
SMILES [?]:
c1cc2c(ccc3c2nno3)c(c1)S(=O)(=O)[O-]
InChi [?]:
InChI=1/C10H6N2O4S/c13-17(14,15)9-3-1-2-7-6(9)4-5-8-10(7)11-12-16-8/h1-5H,(H,13,14,15)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,13,5,6,4,3,7,12,8,9,10,15,16,17,11,14/E:(13,14,15)/CRV:17.6/rA:17nCCCCCCCCNNOCCSOOO-/rB:s1;d2;s3;s4;d5;s6;s3d7;s8;d9;s7s10;d4;d1s12;s12;d14;d14;s14;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H5N2O4S-
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:-27.8739
Area:379.677
Solvation:-37.3658
Coulombic:8.36039
Bond Count [?]
All:19
Single:11
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:249.224
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.88
LogP (Chemaxon):1.51

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Descriptor Annotations

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