3-[(4-nitrophenoxy)methyl]-1-pyrrolidin-1-yl-pentane-1,2-dione

Systemtic Name: 3-[(4-nitrophenoxy)methyl]-1-pyrrolidin-1-yl-pentane-1,2-dione Openeye Name: 3-[(4-nitrophenoxy)methyl]-1-pyrrolidin-1-yl-pentane-1,2-dione CAS Name: 3-[(4-nitrophenoxy)methyl]-1-(1-pyrrolidinyl)pentane-1,2-dione IUPAC Name: 3-[(4-nitrophenoxy)methyl]-1-pyrrolidin-1-ylpentane-1,2-dione Traditional Name: 3-[(4-nitrophenoxy)methyl]-1-pyrrolidino-pentane-1,2-dione Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C(=O)N2CCCC2

Isomeric SMILES

CCC(COC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C(=O)N2CCCC2

InChI

InChI=1S/C16H20N2O5/c1-2-12(15(19)16(20)17-9-3-4-10-17)11-23-14-7-5-13(6-8-14)18(21)22/h5-8,12H,2-4,9-11H2,1H3