AC1NRTB7 structure

AC1NRTB7

4-(5-methoxy-1H-indol-3-yl)-5-nitro-3,8-dioxido-4,5-dihydro-[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole-3,8-diium

Also Known As: 4-(5-methoxy-1H-indol-3-yl)-5-nitro-3,8-dioxido-4,5-dihydro-[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole-3,8-diium|5-(5-Methoxy-1H-indol-3-yl)-4-nitro-1,6-dioxo-4,5-dihydro-1lambda~5~,6lambda~5~-benzo[1,2-c:3,4-c']bis[1,2,5]oxadiazole

CAS: 7230-76-4
Molecular Formula C15H10N6O7
Molecular Weight 386.0611 g/mol
LogP 0.5496
Topological Polar Surface Area 174.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 3
Exact Mass 386.0611
Monoisotopic Mass 386.0611
Heavy Atoms 28
Complexity 1241.199

Chemical Identifiers

CAS Number 7230-76-4
SMILES COC1=CC2=C(C=C1)NC=C2C3C(C4=NO[N+](=C4C5=NO[N+](=C35)[O-])[O-])[N+](=O)[O-]

Product Overview

AC1NRTB7 (CAS 7230-76-4), with molecular formula C15H10N6O7 and molecular weight 386.0611 g/mol. IUPAC: 4-(5-methoxy-1H-indol-3-yl)-5-nitro-3,8-dioxido-4,5-dihydro-[1,2,5]oxadiazolo[3,4-e][2,1,3]benzoxadiazole-3,8-diium.

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