(phenylmethyl) (1R,4S)-5-[5-(oxidanylcarbamoyl)pyrimidin-2-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

Systemtic Name: (phenylmethyl) (1R,4S)-5-[5-(oxidanylcarbamoyl)pyrimidin-2-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Openeye Name: benzyl (1R,4S)-5-[5-(hydroxycarbamoyl)pyrimidin-2-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate CAS Name: (1R,4S)-5-[5-[(hydroxyamino)-oxomethyl]-2-pyrimidinyl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (1R,4S)-5-[5-(hydroxycarbamoyl)pyrimidin-2-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Traditional Name: (1R,4S)-5-[5-(hydroxycarbamoyl)pyrimidin-2-yl]-2,5-diazabicyclo[2.2.1]heptane-2-carboxylic acid benzyl ester Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C1CN2C(=O)OCC3=CC=CC=C3)C4=NC=C(C=N4)C(=O)NO

Isomeric SMILES

C1[C@@H]2CN([C@@H]1CN2C(=O)OCC3=CC=CC=C3)C4=NC=C(C=N4)C(=O)NO

InChI

InChI=1S/C18H19N5O4/c24-16(21-26)13-7-19-17(20-8-13)22-9-15-6-14(22)10-23(15)18(25)27-11-12-4-2-1-3-5-12/h1-5,7-8,14-15,26H,6,9-11H2,(H,21,24)/t14-,15+/m0/s1