2-methylheptan-2-ylazanium; N-(2-methylheptan-2-yl)carbamodithioate

Systemtic Name: 2-methylheptan-2-ylazanium; N-(2-methylheptan-2-yl)carbamodithioate Openeye Name: 1,1-dimethylhexylammonium; N-(1,1-dimethylhexyl)carbamodithioate CAS Name: 2-methylheptan-2-ylammonium; N-(2-methylheptan-2-yl)carbamodithioate IUPAC Name: 2-methylheptan-2-ylazanium; N-(2-methylheptan-2-yl)carbamodithioate Traditional Name: 1,1-dimethylhexylammonium; N-(1,1-dimethylhexyl)carbamodithioate Formula: C17H38N2S2 MolecularWeight: 334.62702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)[NH3+].CCCCCC(C)(C)NC(=S)[S-]

Isomeric SMILES

CCCCCC(C)(C)[NH3+].CCCCCC(C)(C)NC(=S)[S-]

InChI

InChI=1S/C9H19NS2.C8H19N/c1-4-5-6-7-9(2,3)10-8(11)12;1-4-5-6-7-8(2,3)9/h4-7H2,1-3H3,(H2,10,11,12);4-7,9H2,1-3H3