[2-azanyl-5-[[4-azanyl-3-[dibutyl(sulfino)azaniumyl]phenyl]methyl]phenyl]-dibutyl-sulfino-azanium

Systemtic Name: [2-azanyl-5-[[4-azanyl-3-[dibutyl(sulfino)azaniumyl]phenyl]methyl]phenyl]-dibutyl-sulfino-azanium Openeye Name: [2-amino-5-[[4-amino-3-[dibutyl(sulfino)ammonio]phenyl]methyl]phenyl]-dibutyl-sulfino-ammonium CAS Name: [2-amino-5-[[4-amino-3-[dibutyl(sulfino)ammonio]phenyl]methyl]phenyl]-dibutyl-sulfinoammonium IUPAC Name: [2-amino-5-[[4-amino-3-[dibutyl(sulfino)azaniumyl]phenyl]methyl]phenyl]-dibutyl-sulfinoazanium Traditional Name: [2-amino-5-[4-amino-3-[dibutyl(sulfino)ammonio]benzyl]phenyl]-dibutyl-sulfino-ammonium Formula: C29H50N4O4S2+2 MolecularWeight: 582.8617

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCC)(C1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)[N+](CCCC)(CCCC)S(=O)O)N)S(=O)O

Isomeric SMILES

CCCC[N+](CCCC)(C1=C(C=CC(=C1)CC2=CC(=C(C=C2)N)[N+](CCCC)(CCCC)S(=O)O)N)S(=O)O

InChI

InChI=1S/C29H48N4O4S2/c1-5-9-17-32(38(34)35,18-10-6-2)28-22-24(13-15-26(28)30)21-25-14-16-27(31)29(23-25)33(39(36)37,19-11-7-3)20-12-8-4/h13-16,22-23H,5-12,17-21,30-31H2,1-4H3/p+2