methyl 3-[[(2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[(2S)-2-(furan-2-ylcarbonylamino)-3-methyl-butanoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[(2S)-2-(furan-2-carbonylamino)-3-methyl-butanoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(2S)-2-[[2-furanyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[(2S)-2-(furan-2-carbonylamino)-3-methylbutanoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(2S)-2-(2-furoylamino)-3-methyl-butanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5/c1-11(2)16(21-17(22)15-6-5-9-26-15)18(23)20-14-10-13(19(24)25-4)8-7-12(14)3/h5-11,16H,1-4H3,(H,20,23)(H,21,22)/t16-/m0/s1