methyl 1-ethanoyl-2-[2-oxidanylidene-4-(phenylmethoxycarbonylamino)pyrimidin-1-yl]pyrrolidine-2-carboxylate

Systemtic Name: methyl 1-ethanoyl-2-[2-oxidanylidene-4-(phenylmethoxycarbonylamino)pyrimidin-1-yl]pyrrolidine-2-carboxylate Openeye Name: methyl 1-acetyl-2-[4-(benzyloxycarbonylamino)-2-oxo-pyrimidin-1-yl]pyrrolidine-2-carboxylate CAS Name: 1-acetyl-2-[2-oxo-4-(phenylmethoxycarbonylamino)-1-pyrimidinyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-acetyl-2-[2-oxo-4-(phenylmethoxycarbonylamino)pyrimidin-1-yl]pyrrolidine-2-carboxylate Traditional Name: 1-acetyl-2-[4-(benzyloxycarbonylamino)-2-keto-pyrimidin-1-yl]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H22N4O6 MolecularWeight: 414.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC1(C(=O)OC)N2C=CC(=NC2=O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCCC1(C(=O)OC)N2C=CC(=NC2=O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O6/c1-14(25)23-11-6-10-20(23,17(26)29-2)24-12-9-16(21-18(24)27)22-19(28)30-13-15-7-4-3-5-8-15/h3-5,7-9,12H,6,10-11,13H2,1-2H3,(H,21,22,27,28)