N-[4,5-bis(octylsulfonylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]octane-1-sulfonamide

Systemtic Name: N-[4,5-bis(octylsulfonylamino)-9,10-bis(oxidanylidene)anthracen-1-yl]octane-1-sulfonamide Openeye Name: N-[4,5-bis(octylsulfonylamino)-9,10-dioxo-1-anthryl]octane-1-sulfonamide CAS Name: N-[4,5-bis(octylsulfonylamino)-9,10-dioxo-1-anthracenyl]-1-octanesulfonamide IUPAC Name: N-[4,5-bis(octylsulfonylamino)-9,10-dioxoanthracen-1-yl]octane-1-sulfonamide Traditional Name: N-[9,10-diketo-4,5-bis(octylsulfonylamino)-1-anthryl]octane-1-sulfonamide Formula: C38H59N3O8S3 MolecularWeight: 782.08536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)NC1=C2C(=C(C=C1)NS(=O)(=O)CCCCCCCC)C(=O)C3=C(C2=O)C=CC=C3NS(=O)(=O)CCCCCCCC

Isomeric SMILES

CCCCCCCCS(=O)(=O)NC1=C2C(=C(C=C1)NS(=O)(=O)CCCCCCCC)C(=O)C3=C(C2=O)C=CC=C3NS(=O)(=O)CCCCCCCC

InChI

InChI=1S/C38H59N3O8S3/c1-4-7-10-13-16-19-27-50(44,45)39-31-24-22-23-30-34(31)38(43)36-33(41-52(48,49)29-21-18-15-12-9-6-3)26-25-32(35(36)37(30)42)40-51(46,47)28-20-17-14-11-8-5-2/h22-26,39-41H,4-21,27-29H2,1-3H3