[4-azanyl-1-(4-oxidanylphenoxy)-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-azanyl-1-(4-oxidanylphenoxy)-1-phosphono-butyl]phosphonic acid Openeye Name: [4-amino-1-(4-hydroxyphenoxy)-1-phosphono-butyl]phosphonic acid CAS Name: [4-amino-1-(4-hydroxyphenoxy)-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-amino-1-(4-hydroxyphenoxy)-1-phosphonobutyl]phosphonic acid Traditional Name: [4-amino-1-(4-hydroxyphenoxy)-1-phosphono-butyl]phosphonic acid Formula: C10H17NO8P2 MolecularWeight: 341.191402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)OC(CCCN)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=CC(=CC=C1O)OC(CCCN)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C10H17NO8P2/c11-7-1-6-10(20(13,14)15,21(16,17)18)19-9-4-2-8(12)3-5-9/h2-5,12H,1,6-7,11H2,(H2,13,14,15)(H2,16,17,18)