8-[[2-(chloromethyl)-4-methyl-pentanoyl]amino]octanoic acid

Systemtic Name: 8-[[2-(chloromethyl)-4-methyl-pentanoyl]amino]octanoic acid Openeye Name: 8-[[2-(chloromethyl)-4-methyl-pentanoyl]amino]octanoic acid CAS Name: 8-[[2-(chloromethyl)-4-methyl-1-oxopentyl]amino]octanoic acid IUPAC Name: 8-[[2-(chloromethyl)-4-methylpentanoyl]amino]octanoic acid Traditional Name: 8-[[2-(chloromethyl)-4-methyl-pentanoyl]amino]caprylic acid Formula: C15H28ClNO3 MolecularWeight: 305.84072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CCl)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

CC(C)CC(CCl)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C15H28ClNO3/c1-12(2)10-13(11-16)15(20)17-9-7-5-3-4-6-8-14(18)19/h12-13H,3-11H2,1-2H3,(H,17,20)(H,18,19)