7-azanyl-6-methyl-7-phosphono-octanoic acid

Systemtic Name: 7-azanyl-6-methyl-7-phosphono-octanoic acid Openeye Name: 7-amino-6-methyl-7-phosphono-octanoic acid CAS Name: 7-amino-6-methyl-7-phosphonooctanoic acid IUPAC Name: 7-amino-6-methyl-7-phosphonooctanoic acid Traditional Name: 7-amino-6-methyl-7-phosphono-caprylic acid Formula: C9H20NO5P MolecularWeight: 253.232561

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)O)C(C)(N)P(=O)(O)O

Isomeric SMILES

CC(CCCCC(=O)O)C(C)(N)P(=O)(O)O

InChI

InChI=1S/C9H20NO5P/c1-7(5-3-4-6-8(11)12)9(2,10)16(13,14)15/h7H,3-6,10H2,1-2H3,(H,11,12)(H2,13,14,15)