1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: 1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: 1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CAS Name: 1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: 1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: 1-deuterio-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Formula: C10H12NO5P MolecularWeight: 258.185903

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C1C(=CC=C2)P(=O)(O)O)C(=O)O

Isomeric SMILES

[2H]C1C2=C(CC(N1)C(=O)O)C(=CC=C2)P(=O)(O)O

InChI

InChI=1S/C10H12NO5P/c12-10(13)8-4-7-6(5-11-8)2-1-3-9(7)17(14,15)16/h1-3,8,11H,4-5H2,(H,12,13)(H2,14,15,16)/i5D