[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2,4-bis(oxidanylidene)-1H-pyrimidine-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 2,4-bis(oxidanylidene)-1H-pyrimidine-5-carboxylate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 2,4-dioxo-1H-pyrimidine-5-carboxylate CAS Name: 2,4-dioxo-1H-pyrimidine-5-carboxylic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 2,4-dioxo-1H-pyrimidine-5-carboxylate Traditional Name: 2,4-diketo-1H-pyrimidine-5-carboxylic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CNC(=O)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)C2=CNC(=O)NC2=O

InChI

InChI=1S/C14H13N3O5/c18-11(15-6-9-4-2-1-3-5-9)8-22-13(20)10-7-16-14(21)17-12(10)19/h1-5,7H,6,8H2,(H,15,18)(H2,16,17,19,21)