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2,4,5,7-tetranitro-9-octadecylsulfanyl-9H-fluorene

2,4,5,7-tetranitro-9-octadecylsulfanyl-9H-fluorene

Systemtic Name:2,4,5,7-tetranitro-9-octadecylsulfanyl-9H-fluorene
Openeye Name:2,4,5,7-tetranitro-9-octadecylsulfanyl-9H-fluorene
CAS Name:2,4,5,7-tetranitro-9-(octadecylthio)-9H-fluorene
IUPAC Name:2,4,5,7-tetranitro-9-octadecylsulfanyl-9H-fluorene
Traditional Name:2,4,5,7-tetranitro-9-(stearylthio)-9H-fluorene
Formula: C31H42N4O8S
MolecularWeight: 630.75218
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1C2=CC(=CC(=C2C3=C(C=C(C=C13)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1C2=CC(=CC(=C2C3=C(C=C(C=C13)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C31H42N4O8S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-44-31-25-19-23(32(36)37)21-27(34(40)41)29(25)30-26(31)20-24(33(38)39)22-28(30)35(42)43/h19-22,31H,2-18H2,1H3


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