(NE)-N-[(6Z)-4-chloranyl-6-octadecylsulfonylimino-cyclohexa-2,4-dien-1-ylidene]octadecane-1-sulfonamide

Systemtic Name: (NE)-N-[(6Z)-4-chloranyl-6-octadecylsulfonylimino-cyclohexa-2,4-dien-1-ylidene]octadecane-1-sulfonamide Openeye Name: (NE)-N-[(6Z)-4-chloro-6-octadecylsulfonylimino-cyclohexa-2,4-dien-1-ylidene]octadecane-1-sulfonamide CAS Name: (NE)-N-[(6Z)-4-chloro-6-octadecylsulfonylimino-1-cyclohexa-2,4-dienylidene]-1-octadecanesulfonamide IUPAC Name: (NE)-N-[(6Z)-4-chloro-6-octadecylsulfonyliminocyclohexa-2,4-dien-1-ylidene]octadecane-1-sulfonamide Traditional Name: (NE)-N-[(6Z)-4-chloro-6-stearylsulfonylimino-cyclohexa-2,4-dien-1-ylidene]octadecane-1-sulfonamide Formula: C42H77ClN2O4S2 MolecularWeight: 773.65478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)(=O)N=C1C=CC(=CC1=NS(=O)(=O)CCCCCCCCCCCCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)(=O)/N=C/1\C=CC(=C\C1=N\S(=O)(=O)CCCCCCCCCCCCCCCCCC)Cl

InChI

InChI=1S/C42H77ClN2O4S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-50(46,47)44-41-36-35-40(43)39-42(41)45-51(48,49)38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39H,3-34,37-38H2,1-2H3/b44-41+,45-42-