methyl (2S)-2-[2-(furan-2-ylcarbonylamino)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-(furan-2-ylcarbonylamino)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[2-(furan-2-carbonylamino)propanoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[[2-furanyl(oxo)methyl]amino]-1-oxopropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(furan-2-carbonylamino)propanoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[2-(2-furoylamino)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O5/c1-12(19-17(22)15-9-6-10-25-15)16(21)20-14(18(23)24-2)11-13-7-4-3-5-8-13/h3-10,12,14H,11H2,1-2H3,(H,19,22)(H,20,21)/t12?,14-/m0/s1