potassium; (6-hexyl-6-oxidanyl-1-phosphanyl-dodecyl)-tripropyl-phosphanium; tripropylphosphane; hexanitrite

Systemtic Name: potassium; (6-hexyl-6-oxidanyl-1-phosphanyl-dodecyl)-tripropyl-phosphanium; tripropylphosphane; hexanitrite Openeye Name: potassium; (6-hexyl-6-hydroxy-1-phosphanyl-dodecyl)-tripropyl-phosphonium; tripropylphosphane; hexanitrite CAS Name: potassium; (6-hexyl-6-hydroxy-1-phosphinododecyl)-tripropylphosphonium; tripropylphosphine; hexanitrite IUPAC Name: potassium; (6-hexyl-6-hydroxy-1-phosphanyldodecyl)-tripropylphosphanium; tripropylphosphane; hexanitrite Traditional Name: potassium; (6-hexyl-6-hydroxy-1-phosphino-dodecyl)-tripropyl-phosphonium; tripropylphosphine; hexanitrite Formula: C36H80KN6O13P3-4 MolecularWeight: 937.072383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCC)(CCCCC(P)[P+](CCC)(CCC)CCC)O.CCCP(CCC)CCC.N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+]

Isomeric SMILES

CCCCCCC(CCCCCC)(CCCCC(P)[P+](CCC)(CCC)CCC)O.CCCP(CCC)CCC.N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].N(=O)[O-].[K+]

InChI

InChI=1S/C27H59OP2.C9H21P.K.6HNO2/c1-6-11-13-16-20-27(28,21-17-14-12-7-2)22-18-15-19-26(29)30(23-8-3,24-9-4)25-10-5;1-4-7-10(8-5-2)9-6-3;;6*2-1-3/h26,28H,6-25,29H2,1-5H3;4-9H2,1-3H3;;6*(H,2,3)/q+1;;+1;;;;;;/p-6