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Home > Indoles and Oxindole > 923298-08-2
923298-08-2 | Quinoxaline, 2,3-di-1H-indol-3-yl-6-nitro-, compd. with sulfate (1:1)
CAS No: 923298-08-2 Catalog No: AG0067HO MDL No:
Product Description
Catalog Number:
AG0067HO
Chemical Name:
Quinoxaline, 2,3-di-1H-indol-3-yl-6-nitro-, compd. with sulfate (1:1)
CAS Number:
923298-08-2
Molecular Formula:
C24H17N5O6S
Molecular Weight:
503.4867
IUPAC Name:
2,3-bis(1H-indol-3-yl)-6-nitroquinoxaline;sulfuric acid
InChI:
InChI=1S/C24H15N5O2.H2O4S/c30-29(31)14-9-10-21-22(11-14)28-24(18-13-26-20-8-4-2-6-16(18)20)23(27-21)17-12-25-19-7-3-1-5-15(17)19;1-5(2,3)4/h1-13,25-26H;(H2,1,2,3,4)
InChI Key:
SNIVQKOIINRROT-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.[O-][N+](=O)c1ccc2c(c1)nc(c(n2)c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2
Properties
Complexity:
752
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
503.09g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
503.489g/mol
Monoisotopic Mass:
503.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
186A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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