[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone

Systemtic Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone Openeye Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-ethoxy-3-nitro-phenyl)methanone CAS Name: [2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-(4-ethoxy-3-nitrophenyl)methanone IUPAC Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-ethoxy-3-nitrophenyl)methanone Traditional Name: [2-(2,4-dimethoxyphenyl)pyrrolidino]-(4-ethoxy-3-nitro-phenyl)methanone Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCCC2C3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCCC2C3=C(C=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H24N2O6/c1-4-29-19-10-7-14(12-18(19)23(25)26)21(24)22-11-5-6-17(22)16-9-8-15(27-2)13-20(16)28-3/h7-10,12-13,17H,4-6,11H2,1-3H3