6-[diethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-diethyl-(2-phenothiazin-10-ylethyl)azanium

Systemtic Name: 6-[diethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-diethyl-(2-phenothiazin-10-ylethyl)azanium Openeye Name: 6-[diethyl(2-phenothiazin-10-ylethyl)ammonio]hexyl-diethyl-(2-phenothiazin-10-ylethyl)ammonium CAS Name: 6-[diethyl-[2-(10-phenothiazinyl)ethyl]ammonio]hexyl-diethyl-[2-(10-phenothiazinyl)ethyl]ammonium IUPAC Name: 6-[diethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-diethyl-(2-phenothiazin-10-ylethyl)azanium Traditional Name: 6-[diethyl(2-phenothiazin-10-ylethyl)ammonio]hexyl-diethyl-(2-phenothiazin-10-ylethyl)ammonium Formula: C42H56N4S2+2 MolecularWeight: 681.05084

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCCC[N+](CC)(CC)CCN1C2=CC=CC=C2SC3=CC=CC=C31)CCN4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

CC[N+](CC)(CCCCCC[N+](CC)(CC)CCN1C2=CC=CC=C2SC3=CC=CC=C31)CCN4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C42H56N4S2/c1-5-45(6-2,33-29-43-35-21-11-15-25-39(35)47-40-26-16-12-22-36(40)43)31-19-9-10-20-32-46(7-3,8-4)34-30-44-37-23-13-17-27-41(37)48-42-28-18-14-24-38(42)44/h11-18,21-28H,5-10,19-20,29-34H2,1-4H3/q+2