(2-methoxy-5-nitro-phenyl)methyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2-oxo-1-pyrrolidinyl)methyl]benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-[(2-ketopyrrolidino)methyl]benzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC=C(C=C2)CN3CCCC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC=C(C=C2)CN3CCCC3=O

InChI

InChI=1S/C20H20N2O6/c1-27-18-9-8-17(22(25)26)11-16(18)13-28-20(24)15-6-4-14(5-7-15)12-21-10-2-3-19(21)23/h4-9,11H,2-3,10,12-13H2,1H3