methyl (2S)-1-[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]ethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]ethanoyl]pyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxoethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[2-(2,4-dioxo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-(2,4-diketo-1H-quinazolin-3-yl)acetyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)CN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

COC(=O)[C@@H]1CCCN1C(=O)CN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C16H17N3O5/c1-24-15(22)12-7-4-8-18(12)13(20)9-19-14(21)10-5-2-3-6-11(10)17-16(19)23/h2-3,5-6,12H,4,7-9H2,1H3,(H,17,23)/t12-/m0/s1