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

Systemtic Name: 3,3-dimethyl-1-[2-[(4-nitrophenoxy)methyl]pyrrolidin-1-yl]pentane-1,2-dione Openeye Name: 3,3-dimethyl-1-[2-[(4-nitrophenoxy)methyl]pyrrolidin-1-yl]pentane-1,2-dione CAS Name: 3,3-dimethyl-1-[2-[(4-nitrophenoxy)methyl]-1-pyrrolidinyl]pentane-1,2-dione IUPAC Name: 3,3-dimethyl-1-[2-[(4-nitrophenoxy)methyl]pyrrolidin-1-yl]pentane-1,2-dione Traditional Name: 3,3-dimethyl-1-[2-[(4-nitrophenoxy)methyl]pyrrolidino]pentane-1,2-dione Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCC1COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H24N2O5/c1-4-18(2,3)16(21)17(22)19-11-5-6-14(19)12-25-15-9-7-13(8-10-15)20(23)24/h7-10,14H,4-6,11-12H2,1-3H3