tripotassium (2S)-2-[[oxidanidyl(4-phenylbutoxy)phosphoryl]amino]pentanedioate

Systemtic Name: tripotassium (2S)-2-[[oxidanidyl(4-phenylbutoxy)phosphoryl]amino]pentanedioate Openeye Name: tripotassium (2S)-2-[[oxido(4-phenylbutoxy)phosphoryl]amino]pentanedioate CAS Name: tripotassium (2S)-2-[[oxido(4-phenylbutoxy)phosphoryl]amino]pentanedioate IUPAC Name: tripotassium (2S)-2-[[oxido(4-phenylbutoxy)phosphoryl]amino]pentanedioate Traditional Name: tripotassium (2S)-2-[[oxido(4-phenylbutoxy)phosphoryl]amino]glutarate Formula: C15H19K3NO7P MolecularWeight: 473.582521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOP(=O)(NC(CCC(=O)[O-])C(=O)[O-])[O-].[K+].[K+].[K+]

Isomeric SMILES

C1=CC=C(C=C1)CCCCOP(=O)(N[C@@H](CCC(=O)[O-])C(=O)[O-])[O-].[K+].[K+].[K+]

InChI

InChI=1S/C15H22NO7P.3K/c17-14(18)10-9-13(15(19)20)16-24(21,22)23-11-5-4-8-12-6-2-1-3-7-12;;;/h1-3,6-7,13H,4-5,8-11H2,(H,17,18)(H,19,20)(H2,16,21,22);;;/q;3*+1/p-3/t13-;;;/m0.../s1