sodium [2-(1-adamantylmethylimino)-2-azanyl-ethyl]sulfanyl-oxidanyl-phosphinate

Systemtic Name: sodium [2-(1-adamantylmethylimino)-2-azanyl-ethyl]sulfanyl-oxidanyl-phosphinate Openeye Name: sodium [2-(1-adamantylmethylimino)-2-amino-ethyl]sulfanyl-hydroxy-phosphinate CAS Name: sodium [[2-(1-adamantylmethylimino)-2-aminoethyl]thio]-hydroxyphosphinate IUPAC Name: sodium [2-(1-adamantylmethylimino)-2-aminoethyl]sulfanyl-hydroxyphosphinate Traditional Name: sodium [[2-(1-adamantylmethylimino)-2-amino-ethyl]thio]-hydroxy-phosphinate Formula: C13H22N2NaO3PS MolecularWeight: 340.353911

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN=C(CSP(=O)(O)[O-])N.[Na+]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN=C(CSP(=O)(O)[O-])N.[Na+]

InChI

InChI=1S/C13H23N2O3PS.Na/c14-12(7-20-19(16,17)18)15-8-13-4-9-1-10(5-13)3-11(2-9)6-13;/h9-11H,1-8H2,(H2,14,15)(H2,16,17,18);/q;+1/p-1