methyl (2S)-3-methyl-2-[1-(3-methylphenyl)ethylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[1-(3-methylphenyl)ethylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[1-(m-tolyl)ethylamino]butanoate CAS Name: (2S)-3-methyl-2-[1-(3-methylphenyl)ethylamino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[1-(3-methylphenyl)ethylamino]butanoate Traditional Name: (2S)-3-methyl-2-[1-(m-tolyl)ethylamino]butyric acid methyl ester Formula: C15H23NO2 MolecularWeight: 249.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C)NC(C(C)C)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)C(C)N[C@@H](C(C)C)C(=O)OC

InChI

InChI=1S/C15H23NO2/c1-10(2)14(15(17)18-5)16-12(4)13-8-6-7-11(3)9-13/h6-10,12,14,16H,1-5H3/t12?,14-/m0/s1