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

Systemtic Name: (2S)-1-(4-methoxy-3-nitro-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: (2S)-1-(4-methoxy-3-nitro-benzoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(4-methoxy-3-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-(4-methoxy-3-nitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-methoxy-3-nitro-benzoyl)pyrrolidine-2-carboxylate Formula: C13H13N2O6- MolecularWeight: 293.25212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC[C@H]2C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O6/c1-21-11-5-4-8(7-10(11)15(19)20)12(16)14-6-2-3-9(14)13(17)18/h4-5,7,9H,2-3,6H2,1H3,(H,17,18)/p-1/t9-/m0/s1