2-(4-methoxyphenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate

Systemtic Name: 2-(4-methoxyphenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate Openeye Name: 2-(4-methoxyphenoxy)ethyl 5-nitro-2-pyrrolidin-1-yl-benzoate CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid 2-(4-methoxyphenoxy)ethyl ester IUPAC Name: 2-(4-methoxyphenoxy)ethyl 5-nitro-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid 2-(4-methoxyphenoxy)ethyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)OCCOC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C20H22N2O6/c1-26-16-5-7-17(8-6-16)27-12-13-28-20(23)18-14-15(22(24)25)4-9-19(18)21-10-2-3-11-21/h4-9,14H,2-3,10-13H2,1H3