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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CO1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

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