(4-butan-2-ylphenyl)methyl-[2-[(4-butan-2-ylphenyl)methyl-dimethyl-azaniumyl]ethyl]-dimethyl-azanium

Systemtic Name: (4-butan-2-ylphenyl)methyl-[2-[(4-butan-2-ylphenyl)methyl-dimethyl-azaniumyl]ethyl]-dimethyl-azanium Openeye Name: 2-[dimethyl-[(4-sec-butylphenyl)methyl]ammonio]ethyl-dimethyl-[(4-sec-butylphenyl)methyl]ammonium CAS Name: (4-butan-2-ylphenyl)methyl-[2-[(4-butan-2-ylphenyl)methyl-dimethylammonio]ethyl]-dimethylammonium IUPAC Name: (4-butan-2-ylphenyl)methyl-[2-[(4-butan-2-ylphenyl)methyl-dimethylazaniumyl]ethyl]-dimethylazanium Traditional Name: 2-[dimethyl-(4-sec-butylbenzyl)ammonio]ethyl-dimethyl-(4-sec-butylbenzyl)ammonium Formula: C28H46N2+2 MolecularWeight: 410.67824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CC[N+](C)(C)CC2=CC=C(C=C2)C(C)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C[N+](C)(C)CC[N+](C)(C)CC2=CC=C(C=C2)C(C)CC

InChI

InChI=1S/C28H46N2/c1-9-23(3)27-15-11-25(12-16-27)21-29(5,6)19-20-30(7,8)22-26-13-17-28(18-14-26)24(4)10-2/h11-18,23-24H,9-10,19-22H2,1-8H3/q+2