2-(4-methoxyphenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate

Systemtic Name: 2-(4-methoxyphenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: 2-(4-methoxyphenoxy)ethyl 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid 2-(4-methoxyphenoxy)ethyl ester IUPAC Name: 2-(4-methoxyphenoxy)ethyl 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid 2-(4-methoxyphenoxy)ethyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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