methyl (2S)-2-[2-(3,4-dimethylphenyl)ethanoylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[2-(3,4-dimethylphenyl)ethanoylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[2-(3,4-dimethylphenyl)acetyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[2-(3,4-dimethylphenyl)-1-oxoethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(3,4-dimethylphenyl)acetyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[2-(3,4-dimethylphenyl)acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-10(2)15(16(19)20-5)17-14(18)9-13-7-6-11(3)12(4)8-13/h6-8,10,15H,9H2,1-5H3,(H,17,18)/t15-/m0/s1