[oxidanyl-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid

Systemtic Name: [oxidanyl-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid Openeye Name: [hydroxy-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid CAS Name: [hydroxy-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid IUPAC Name: [hydroxy-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid Traditional Name: [hydroxy-phosphono-(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]phosphonic acid Formula: C10H15NO7P2 MolecularWeight: 323.176122

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=CC=CC=C21)C(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1C(NCC2=CC=CC=C21)C(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C10H15NO7P2/c12-10(19(13,14)15,20(16,17)18)9-5-7-3-1-2-4-8(7)6-11-9/h1-4,9,11-12H,5-6H2,(H2,13,14,15)(H2,16,17,18)