2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one; (4-oxidanylpyrrolidin-2-yl)-phenyl-methanone

Systemtic Name: 2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one; (4-oxidanylpyrrolidin-2-yl)-phenyl-methanone Openeye Name: (4-hydroxypyrrolidin-2-yl)-phenyl-methanone; 2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one CAS Name: (4-hydroxy-2-pyrrolidinyl)-phenylmethanone; 2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one IUPAC Name: (4-hydroxypyrrolidin-2-yl)-phenylmethanone; 2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one Traditional Name: (4-hydroxypyrrolidin-2-yl)-phenyl-methanone; 2-nitro-3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CNC1C(=O)C2=CC=CC=C2)O.C1=CC2=CC=C1C(OC2=O)[N+](=O)[O-]

Isomeric SMILES

C1C(CNC1C(=O)C2=CC=CC=C2)O.C1=CC2=CC=C1C(OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C11H13NO2.C8H5NO4/c13-9-6-10(12-7-9)11(14)8-4-2-1-3-5-8;10-8-6-3-1-5(2-4-6)7(13-8)9(11)12/h1-5,9-10,12-13H,6-7H2;1-4,7H