sodium [3-azanyl-2-(4-chlorophenyl)-2-oxidanyl-propyl]-butyl-phosphinate

Systemtic Name: sodium [3-azanyl-2-(4-chlorophenyl)-2-oxidanyl-propyl]-butyl-phosphinate Openeye Name: sodium [3-amino-2-(4-chlorophenyl)-2-hydroxy-propyl]-butyl-phosphinate CAS Name: sodium [3-amino-2-(4-chlorophenyl)-2-hydroxypropyl]-butylphosphinate IUPAC Name: sodium [3-amino-2-(4-chlorophenyl)-2-hydroxypropyl]-butylphosphinate Traditional Name: sodium [3-amino-2-(4-chlorophenyl)-2-hydroxy-propyl]-butyl-phosphinate Formula: C13H20ClNNaO3P MolecularWeight: 327.719331

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Descriptors Computed from Structure

Canonical SMILES:

CCCCP(=O)(CC(CN)(C1=CC=C(C=C1)Cl)O)[O-].[Na+]

Isomeric SMILES

CCCCP(=O)(CC(CN)(C1=CC=C(C=C1)Cl)O)[O-].[Na+]

InChI

InChI=1S/C13H21ClNO3P.Na/c1-2-3-8-19(17,18)10-13(16,9-15)11-4-6-12(14)7-5-11;/h4-7,16H,2-3,8-10,15H2,1H3,(H,17,18);/q;+1/p-1