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[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl] dodecane-1-sulfonate

[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl] dodecane-1-sulfonate

Systemtic Name:[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl] dodecane-1-sulfonate
Openeye Name:(1,3-dioxobenzo[e]isoindol-2-yl) dodecane-1-sulfonate
CAS Name:1-dodecanesulfonic acid
IUPAC Name:(1,3-dioxobenzo[e]isoindol-2-yl) dodecane-1-sulfonate
Traditional Name:dodecane-1-sulfonic acid (1,3-diketobenz[e]isoindol-2-yl) ester
Formula: C24H31NO5S
MolecularWeight: 445.57164
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS(=O)(=O)ON1C(=O)C2=C(C1=O)C3=CC=CC=C3C=C2


Isomeric SMILES

CCCCCCCCCCCCS(=O)(=O)ON1C(=O)C2=C(C1=O)C3=CC=CC=C3C=C2


InChI

InChI=1S/C24H31NO5S/c1-2-3-4-5-6-7-8-9-10-13-18-31(28,29)30-25-23(26)21-17-16-19-14-11-12-15-20(19)22(21)24(25)27/h11-12,14-17H,2-10,13,18H2,1H3


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