azanium 8-methyl-9-oxidanyl-9-oxidanylidene-nonanoate

Systemtic Name: azanium 8-methyl-9-oxidanyl-9-oxidanylidene-nonanoate Openeye Name: ammonium 9-hydroxy-8-methyl-9-oxo-nonanoate CAS Name: ammonium 9-hydroxy-8-methyl-9-oxononanoate IUPAC Name: azanium 9-hydroxy-8-methyl-9-oxononanoate Traditional Name: ammonium 9-hydroxy-9-keto-8-methyl-pelargonate Formula: C10H21NO4 MolecularWeight: 219.27804

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCC(=O)[O-])C(=O)O.[NH4+]

Isomeric SMILES

CC(CCCCCCC(=O)[O-])C(=O)O.[NH4+]

InChI

InChI=1S/C10H18O4.H3N/c1-8(10(13)14)6-4-2-3-5-7-9(11)12;/h8H,2-7H2,1H3,(H,11,12)(H,13,14);1H3