N-[(3-carboxyphenyl)methyl]-2-oxidanyl-2-oxidanylidene-N-(phosphonomethyl)ethanamine oxide

Systemtic Name: N-[(3-carboxyphenyl)methyl]-2-oxidanyl-2-oxidanylidene-N-(phosphonomethyl)ethanamine oxide Openeye Name: N-[(3-carboxyphenyl)methyl]-2-hydroxy-2-oxo-N-(phosphonomethyl)ethanamine oxide CAS Name: N-[(3-carboxyphenyl)methyl]-2-hydroxy-2-oxo-N-(phosphonomethyl)ethanamine oxide IUPAC Name: N-[(3-carboxyphenyl)methyl]-2-hydroxy-2-oxo-N-(phosphonomethyl)ethanamine oxide Traditional Name: N-(3-carboxybenzyl)-2-hydroxy-2-keto-N-(phosphonomethyl)ethanamine oxide Formula: C11H14NO8P MolecularWeight: 319.204521

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C[N+](CC(=O)O)(CP(=O)(O)O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C[N+](CC(=O)O)(CP(=O)(O)O)[O-])C(=O)O

InChI

InChI=1S/C11H14NO8P/c13-10(14)6-12(17,7-21(18,19)20)5-8-2-1-3-9(4-8)11(15)16/h1-4H,5-7H2,(H,13,14)(H,15,16)(H2,18,19,20)