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

Systemtic Name: methyl 3-methyl-5-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonyloxymethyl]furan-2-carboxylate Openeye Name: methyl 3-methyl-5-[(3-nitro-4-pyrrolidin-1-yl-benzoyl)oxymethyl]furan-2-carboxylate CAS Name: 3-methyl-5-[[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-5-[(3-nitro-4-pyrrolidin-1-ylbenzoyl)oxymethyl]furan-2-carboxylate Traditional Name: 3-methyl-5-[(3-nitro-4-pyrrolidino-benzoyl)oxymethyl]furan-2-carboxylic acid methyl ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)COC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H20N2O7/c1-12-9-14(28-17(12)19(23)26-2)11-27-18(22)13-5-6-15(16(10-13)21(24)25)20-7-3-4-8-20/h5-6,9-10H,3-4,7-8,11H2,1-2H3