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9-[6-(2,4-dinitrophenyl)sulfanylcyclohexen-1-yl]phenanthrene

9-[6-(2,4-dinitrophenyl)sulfanylcyclohexen-1-yl]phenanthrene

Systemtic Name:9-[6-(2,4-dinitrophenyl)sulfanylcyclohexen-1-yl]phenanthrene
Openeye Name:9-[6-(2,4-dinitrophenyl)sulfanylcyclohexen-1-yl]phenanthrene
CAS Name:9-[6-[(2,4-dinitrophenyl)thio]-1-cyclohexenyl]phenanthrene
IUPAC Name:9-[6-(2,4-dinitrophenyl)sulfanylcyclohexen-1-yl]phenanthrene
Traditional Name:9-[6-[(2,4-dinitrophenyl)thio]cyclohexen-1-yl]phenanthrene
Formula: C26H20N2O4S
MolecularWeight: 456.513
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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(C1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC4=CC=CC=C4C5=CC=CC=C53


Isomeric SMILES

C1CC=C(C(C1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC4=CC=CC=C4C5=CC=CC=C53


InChI

InChI=1S/C26H20N2O4S/c29-27(30)18-13-14-26(24(16-18)28(31)32)33-25-12-6-5-11-22(25)23-15-17-7-1-2-8-19(17)20-9-3-4-10-21(20)23/h1-4,7-11,13-16,25H,5-6,12H2


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