methyl 5-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[(3-nitro-4-pyrrolidin-1-yl-benzoyl)oxymethyl]furan-2-carboxylate CAS Name: 5-[[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(3-nitro-4-pyrrolidin-1-ylbenzoyl)oxymethyl]furan-2-carboxylate Traditional Name: 5-[(3-nitro-4-pyrrolidino-benzoyl)oxymethyl]furan-2-carboxylic acid methyl ester Formula: C18H18N2O7 MolecularWeight: 374.34472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(O1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O7/c1-25-18(22)16-7-5-13(27-16)11-26-17(21)12-4-6-14(15(10-12)20(23)24)19-8-2-3-9-19/h4-7,10H,2-3,8-9,11H2,1H3