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

Systemtic Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-morpholin-4-yl-3-nitro-phenyl)methanone Openeye Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-morpholino-3-nitro-phenyl)methanone CAS Name: [2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-[4-(4-morpholinyl)-3-nitrophenyl]methanone IUPAC Name: [2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(4-morpholin-4-yl-3-nitrophenyl)methanone Traditional Name: [2-(2,4-dimethoxyphenyl)pyrrolidino]-(4-morpholino-3-nitro-phenyl)methanone Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H27N3O6/c1-30-17-6-7-18(22(15-17)31-2)19-4-3-9-25(19)23(27)16-5-8-20(21(14-16)26(28)29)24-10-12-32-13-11-24/h5-8,14-15,19H,3-4,9-13H2,1-2H3