7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: 7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: 7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CAS Name: 7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: 7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: 7-methyl-5-phosphono-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Formula: C11H14NO5P MolecularWeight: 271.206321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CC(NCC2=C1)C(=O)O)P(=O)(O)O

Isomeric SMILES

CC1=CC(=C2CC(NCC2=C1)C(=O)O)P(=O)(O)O

InChI

InChI=1S/C11H14NO5P/c1-6-2-7-5-12-9(11(13)14)4-8(7)10(3-6)18(15,16)17/h2-3,9,12H,4-5H2,1H3,(H,13,14)(H2,15,16,17)