sodium [2-azanyl-2-(cyclooctylmethylimino)ethyl]sulfanyl-oxidanyl-phosphinate hydrate

Systemtic Name: sodium [2-azanyl-2-(cyclooctylmethylimino)ethyl]sulfanyl-oxidanyl-phosphinate hydrate Openeye Name: sodium [2-amino-2-(cyclooctylmethylimino)ethyl]sulfanyl-hydroxy-phosphinate hydrate CAS Name: sodium [[2-amino-2-(cyclooctylmethylimino)ethyl]thio]-hydroxyphosphinate hydrate IUPAC Name: sodium [2-amino-2-(cyclooctylmethylimino)ethyl]sulfanyl-hydroxyphosphinate hydrate Traditional Name: sodium [[2-amino-2-(cyclooctylmethylimino)ethyl]thio]-hydroxy-phosphinate hydrate Formula: C11H24N2NaO4PS MolecularWeight: 334.347791

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.O.[Na+]

Isomeric SMILES

C1CCCC(CCC1)CN=C(CSP(=O)(O)[O-])N.O.[Na+]

InChI

InChI=1S/C11H23N2O3PS.Na.H2O/c12-11(9-18-17(14,15)16)13-8-10-6-4-2-1-3-5-7-10;;/h10H,1-9H2,(H2,12,13)(H2,14,15,16);;1H2/q;+1;/p-1