1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(3-nitrophenoxy)ethanone

Systemtic Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(3-nitrophenoxy)ethanone Openeye Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(3-nitrophenoxy)ethanone CAS Name: 1-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-(3-nitrophenoxy)ethanone IUPAC Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(3-nitrophenoxy)ethanone Traditional Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidino]-2-(3-nitrophenoxy)ethanone Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-26-15-8-9-19(27-2)17(12-15)18-7-4-10-21(18)20(23)13-28-16-6-3-5-14(11-16)22(24)25/h3,5-6,8-9,11-12,18H,4,7,10,13H2,1-2H3