7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: 7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: 7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CAS Name: 7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: 7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: 7-(phosphonomethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Formula: C11H14NO5P MolecularWeight: 271.206321

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14NO5P/c13-11(14)10-4-8-2-1-7(6-18(15,16)17)3-9(8)5-12-10/h1-3,10,12H,4-6H2,(H,13,14)(H2,15,16,17)