1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone

Systemtic Name: 1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone Openeye Name: 1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(2-methoxy-5-nitro-phenoxy)ethanone CAS Name: 1-[(2R)-2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-(2-methoxy-5-nitrophenoxy)ethanone IUPAC Name: 1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-(2-methoxy-5-nitrophenoxy)ethanone Traditional Name: 1-[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidino]-2-(2-methoxy-5-nitro-phenoxy)ethanone Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@H]2CCCN2C(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H24N2O7/c1-27-15-7-9-18(28-2)16(12-15)17-5-4-10-22(17)21(24)13-30-20-11-14(23(25)26)6-8-19(20)29-3/h6-9,11-12,17H,4-5,10,13H2,1-3H3/t17-/m1/s1