3-azanyl-7-methyl-2-oxidanyl-4-(3-oxidanylpropyl)octanoic acid

Systemtic Name: 3-azanyl-7-methyl-2-oxidanyl-4-(3-oxidanylpropyl)octanoic acid Openeye Name: 3-amino-2-hydroxy-4-(3-hydroxypropyl)-7-methyl-octanoic acid CAS Name: 3-amino-2-hydroxy-4-(3-hydroxypropyl)-7-methyloctanoic acid IUPAC Name: 3-amino-2-hydroxy-4-(3-hydroxypropyl)-7-methyloctanoic acid Traditional Name: 3-amino-2-hydroxy-4-(3-hydroxypropyl)-7-methyl-caprylic acid Formula: C12H25NO4 MolecularWeight: 247.3312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CCCO)C(C(C(=O)O)O)N

Isomeric SMILES

CC(C)CCC(CCCO)C(C(C(=O)O)O)N

InChI

InChI=1S/C12H25NO4/c1-8(2)5-6-9(4-3-7-14)10(13)11(15)12(16)17/h8-11,14-15H,3-7,13H2,1-2H3,(H,16,17)