azane; 7-oxidanylideneoctanoic acid

Systemtic Name: azane; 7-oxidanylideneoctanoic acid Openeye Name: ammonia; 7-oxooctanoic acid CAS Name: ammonia; 7-oxooctanoic acid IUPAC Name: azane; 7-oxooctanoic acid Traditional Name: ammonia; 7-ketocaprylic acid Formula: C8H17NO3 MolecularWeight: 175.22548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCC(=O)O.N

Isomeric SMILES

CC(=O)CCCCCC(=O)O.N

InChI

InChI=1S/C8H14O3.H3N/c1-7(9)5-3-2-4-6-8(10)11;/h2-6H2,1H3,(H,10,11);1H3