methyl (2R)-2-[3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2R)-2-[3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2R)-3-hydroxy-2-[3-(3-methyl-4-oxo-quinazolin-2-yl)propanoylamino]propanoate CAS Name: (2R)-3-hydroxy-2-[[3-(3-methyl-4-oxo-2-quinazolinyl)-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-hydroxy-2-[3-(3-methyl-4-oxoquinazolin-2-yl)propanoylamino]propanoate Traditional Name: (2R)-3-hydroxy-2-[3-(4-keto-3-methyl-quinazolin-2-yl)propanoylamino]propionic acid methyl ester Formula: C16H19N3O5 MolecularWeight: 333.33916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)NC(CO)C(=O)OC

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)N[C@H](CO)C(=O)OC

InChI

InChI=1S/C16H19N3O5/c1-19-13(17-11-6-4-3-5-10(11)15(19)22)7-8-14(21)18-12(9-20)16(23)24-2/h3-6,12,20H,7-9H2,1-2H3,(H,18,21)/t12-/m1/s1