2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethyl-azaniumyl]hexyl]-dimethyl-azanium

Systemtic Name: 2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethyl-azaniumyl]hexyl]-dimethyl-azanium Openeye Name: 2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium CAS Name: 2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethylammonio]hexyl]-dimethylammonium IUPAC Name: 2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethylazaniumyl]hexyl]-dimethylazanium Traditional Name: 2-[bis(2-methylphenoxy)phosphorylamino]ethyl-[6-[2-[bis(2-methylphenoxy)phosphorylamino]ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium Formula: C42H62N4O6P2+2 MolecularWeight: 780.912402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OP(=O)(NCC[N+](C)(C)CCCCCC[N+](C)(C)CCNP(=O)(OC2=CC=CC=C2C)OC3=CC=CC=C3C)OC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1OP(=O)(NCC[N+](C)(C)CCCCCC[N+](C)(C)CCNP(=O)(OC2=CC=CC=C2C)OC3=CC=CC=C3C)OC4=CC=CC=C4C

InChI

InChI=1S/C42H62N4O6P2/c1-35-21-11-15-25-39(35)49-53(47,50-40-26-16-12-22-36(40)2)43-29-33-45(5,6)31-19-9-10-20-32-46(7,8)34-30-44-54(48,51-41-27-17-13-23-37(41)3)52-42-28-18-14-24-38(42)4/h11-18,21-28H,9-10,19-20,29-34H2,1-8H3,(H,43,47)(H,44,48)/q+2