7-methyloctan-1-amine; 7-methyloctanoic acid

Systemtic Name: 7-methyloctan-1-amine; 7-methyloctanoic acid Openeye Name: 7-methyloctan-1-amine; 7-methyloctanoic acid CAS Name: 7-methyl-1-octanamine; 7-methyloctanoic acid IUPAC Name: 7-methyloctan-1-amine; 7-methyloctanoic acid Traditional Name: 7-methylcaprylic acid; 7-methyloctylamine Formula: C18H39NO2 MolecularWeight: 301.50776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H21N.C9H18O2/c1-9(2)7-5-3-4-6-8-10;1-8(2)6-4-3-5-7-9(10)11/h9H,3-8,10H2,1-2H3;8H,3-7H2,1-2H3,(H,10,11)