1-[3-(4-chloranylphenoxy)pyrrolidin-1-yl]-3-(5-methoxy-2-nitro-phenoxy)propan-2-ol

Systemtic Name: 1-[3-(4-chloranylphenoxy)pyrrolidin-1-yl]-3-(5-methoxy-2-nitro-phenoxy)propan-2-ol Openeye Name: 1-[3-(4-chlorophenoxy)pyrrolidin-1-yl]-3-(5-methoxy-2-nitro-phenoxy)propan-2-ol CAS Name: 1-[3-(4-chlorophenoxy)-1-pyrrolidinyl]-3-(5-methoxy-2-nitrophenoxy)-2-propanol IUPAC Name: 1-[3-(4-chlorophenoxy)pyrrolidin-1-yl]-3-(5-methoxy-2-nitrophenoxy)propan-2-ol Traditional Name: 1-[3-(4-chlorophenoxy)pyrrolidino]-3-(5-methoxy-2-nitro-phenoxy)propan-2-ol Formula: C20H23ClN2O6 MolecularWeight: 422.85942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+](=O)[O-])OCC(CN2CCC(C2)OC3=CC=C(C=C3)Cl)O

Isomeric SMILES

COC1=CC(=C(C=C1)[N+](=O)[O-])OCC(CN2CCC(C2)OC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H23ClN2O6/c1-27-17-6-7-19(23(25)26)20(10-17)28-13-15(24)11-22-9-8-18(12-22)29-16-4-2-14(21)3-5-16/h2-7,10,15,18,24H,8-9,11-13H2,1H3