methyl 1-(4-methoxy-2-nitro-3-oxidanyl-phenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-(4-methoxy-2-nitro-3-oxidanyl-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-(3-hydroxy-4-methoxy-2-nitro-benzoyl)pyrrolidine-2-carboxylate CAS Name: 1-[(3-hydroxy-4-methoxy-2-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-hydroxy-4-methoxy-2-nitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: 1-(3-hydroxy-4-methoxy-2-nitro-benzoyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C14H16N2O7 MolecularWeight: 324.28604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)N2CCCC2C(=O)OC)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)N2CCCC2C(=O)OC)[N+](=O)[O-])O

InChI

InChI=1S/C14H16N2O7/c1-22-10-6-5-8(11(12(10)17)16(20)21)13(18)15-7-3-4-9(15)14(19)23-2/h5-6,9,17H,3-4,7H2,1-2H3