2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-N-oxidanyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-N-oxidanyl-pyrimidine-5-carboxamide Openeye Name: 2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidine-5-carbohydroxamic acid CAS Name: 2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-N-hydroxy-5-pyrimidinecarboxamide IUPAC Name: 2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-N-hydroxypyrimidine-5-carboxamide Traditional Name: 2-[(1R,4S)-5-(1,3-benzodioxol-5-yl)-2,5-diazabicyclo[2.2.1]heptan-2-yl]pyrimidine-5-carbohydroxamic acid Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C1CN2C3=NC=C(C=N3)C(=O)NO)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1[C@@H]2CN([C@@H]1CN2C3=NC=C(C=N3)C(=O)NO)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C17H17N5O4/c23-16(20-24)10-5-18-17(19-6-10)22-8-12-3-13(22)7-21(12)11-1-2-14-15(4-11)26-9-25-14/h1-2,4-6,12-13,24H,3,7-9H2,(H,20,23)/t12-,13+/m0/s1