8-oxidanylidene-8-(2,3,4-trimethylhexan-3-ylamino)octanoic acid

Systemtic Name: 8-oxidanylidene-8-(2,3,4-trimethylhexan-3-ylamino)octanoic acid Openeye Name: 8-[(1-isopropyl-1,2-dimethyl-butyl)amino]-8-oxo-octanoic acid CAS Name: 8-oxo-8-(2,3,4-trimethylhexan-3-ylamino)octanoic acid IUPAC Name: 8-oxo-8-(2,3,4-trimethylhexan-3-ylamino)octanoic acid Traditional Name: 8-[(1-isopropyl-1,2-dimethyl-butyl)amino]-8-keto-caprylic acid Formula: C17H33NO3 MolecularWeight: 299.44882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)(C(C)C)NC(=O)CCCCCCC(=O)O

Isomeric SMILES

CCC(C)C(C)(C(C)C)NC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C17H33NO3/c1-6-14(4)17(5,13(2)3)18-15(19)11-9-7-8-10-12-16(20)21/h13-14H,6-12H2,1-5H3,(H,18,19)(H,20,21)