7-methyloctan-1-amine; octanoic acid

Systemtic Name: 7-methyloctan-1-amine; octanoic acid Openeye Name: 7-methyloctan-1-amine; octanoic acid CAS Name: 7-methyl-1-octanamine; octanoic acid IUPAC Name: 7-methyloctan-1-amine; octanoic acid Traditional Name: caprylic acid; 7-methyloctylamine Formula: C17H37NO2 MolecularWeight: 287.48118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)O.CC(C)CCCCCCN

Isomeric SMILES

CCCCCCCC(=O)O.CC(C)CCCCCCN

InChI

InChI=1S/C9H21N.C8H16O2/c1-9(2)7-5-3-4-6-8-10;1-2-3-4-5-6-7-8(9)10/h9H,3-8,10H2,1-2H3;2-7H2,1H3,(H,9,10)