methyl (2S)-3-methyl-2-(5-methylhexan-2-ylamino)butanoate

Systemtic Name: methyl (2S)-3-methyl-2-(5-methylhexan-2-ylamino)butanoate Openeye Name: methyl (2S)-2-(1,4-dimethylpentylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(5-methylhexan-2-ylamino)butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-(5-methylhexan-2-ylamino)butanoate Traditional Name: (2S)-2-(1,4-dimethylpentylamino)-3-methyl-butyric acid methyl ester Formula: C13H27NO2 MolecularWeight: 229.35898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC(C)CCC(C)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C13H27NO2/c1-9(2)7-8-11(5)14-12(10(3)4)13(15)16-6/h9-12,14H,7-8H2,1-6H3/t11?,12-/m0/s1