N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-methyl-2-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-methyl-2-nitro-phenyl)furan-2-carboxamide Openeye Name: 5-(4-methyl-2-nitro-phenyl)-N-(2-methylquinuclidin-3-yl)furan-2-carboxamide CAS Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-methyl-2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-(2-methyl-1-azabicyclo[2.2.2]octan-3-yl)-5-(4-methyl-2-nitrophenyl)furan-2-carboxamide Traditional Name: 5-(4-methyl-2-nitro-phenyl)-N-(2-methylquinuclidin-3-yl)-2-furamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(O3)C4=C(C=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1C(C2CCN1CC2)NC(=O)C3=CC=C(O3)C4=C(C=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4/c1-12-3-4-15(16(11-12)23(25)26)17-5-6-18(27-17)20(24)21-19-13(2)22-9-7-14(19)8-10-22/h3-6,11,13-14,19H,7-10H2,1-2H3,(H,21,24)