sodium; 2-azanyl-1-phenyl-ethanethiol; dihydrogen phosphate

Systemtic Name: sodium; 2-azanyl-1-phenyl-ethanethiol; dihydrogen phosphate Openeye Name: sodium; 2-amino-1-phenyl-ethanethiol; dihydrogen phosphate CAS Name: sodium; 2-amino-1-phenylethanethiol; dihydrogen phosphate IUPAC Name: sodium; 2-amino-1-phenylethanethiol; dihydrogen phosphate Traditional Name: sodium; 2-amino-1-phenyl-ethanethiol; dihydrogen phosphate Formula: C8H13NNaO4PS MolecularWeight: 273.221651

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN)S.OP(=O)(O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(CN)S.OP(=O)(O)[O-].[Na+]

InChI

InChI=1S/C8H11NS.Na.H3O4P/c9-6-8(10)7-4-2-1-3-5-7;;1-5(2,3)4/h1-5,8,10H,6,9H2;;(H3,1,2,3,4)/q;+1;/p-1