(3,4-dimethylphenyl) (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate

Systemtic Name: (3,4-dimethylphenyl) (2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoate Openeye Name: (3,4-dimethylphenyl) (2S)-2-(furan-2-carbonylamino)-3-methyl-butanoate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methylbutanoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) (2S)-2-(furan-2-carbonylamino)-3-methylbutanoate Traditional Name: (2S)-2-(2-furoylamino)-3-methyl-butyric acid (3,4-dimethylphenyl) ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C(C(C)C)NC(=O)C2=CC=CO2)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)[C@H](C(C)C)NC(=O)C2=CC=CO2)C

InChI

InChI=1S/C18H21NO4/c1-11(2)16(19-17(20)15-6-5-9-22-15)18(21)23-14-8-7-12(3)13(4)10-14/h5-11,16H,1-4H3,(H,19,20)/t16-/m0/s1