N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide CAS Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-(1-pyrrolidinylmethyl)-2-furancarboxamide IUPAC Name: N-[3-(3,5-dimethylphenoxy)-5-nitrophenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[3-(3,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidinomethyl)-2-furamide Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCC4)C

InChI

InChI=1S/C24H25N3O5/c1-16-9-17(2)11-21(10-16)31-22-13-18(12-19(14-22)27(29)30)25-24(28)23-6-5-20(32-23)15-26-7-3-4-8-26/h5-6,9-14H,3-4,7-8,15H2,1-2H3,(H,25,28)