tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate

Systemtic Name: tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate Openeye Name: tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate CAS Name: tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate IUPAC Name: tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate Traditional Name: tripotassium 4-(3-phenoxyphenyl)butyl-(phosphonatomethyl)phosphinate Formula: C17H19K3O6P2 MolecularWeight: 498.571582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CCCCP(=O)(CP(=O)([O-])[O-])[O-].[K+].[K+].[K+]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CCCCP(=O)(CP(=O)([O-])[O-])[O-].[K+].[K+].[K+]

InChI

InChI=1S/C17H22O6P2.3K/c18-24(19,14-25(20,21)22)12-5-4-7-15-8-6-11-17(13-15)23-16-9-2-1-3-10-16;;;/h1-3,6,8-11,13H,4-5,7,12,14H2,(H,18,19)(H2,20,21,22);;;/q;3*+1/p-3