3-nitro-4-pyrrolidin-1-yl-chromen-2-one

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-chromen-2-one Openeye Name: 3-nitro-4-pyrrolidin-1-yl-chromen-2-one CAS Name: 3-nitro-4-(1-pyrrolidinyl)-1-benzopyran-2-one IUPAC Name: 3-nitro-4-pyrrolidin-1-ylchromen-2-one Traditional Name: 3-nitro-4-pyrrolidino-coumarin Formula: C13H12N2O4 MolecularWeight: 260.24538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4/c16-13-12(15(17)18)11(14-7-3-4-8-14)9-5-1-2-6-10(9)19-13/h1-2,5-6H,3-4,7-8H2