methyl (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(3-methylcyclohexyl)amino]butyric acid methyl ester Formula: C13H25NO2 MolecularWeight: 227.3431

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1CCCC(C1)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C13H25NO2/c1-9(2)12(13(15)16-4)14-11-7-5-6-10(3)8-11/h9-12,14H,5-8H2,1-4H3/t10?,11?,12-/m0/s1