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

Systemtic Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[3-(2,5-dimethylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide CAS Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-5-(1-pyrrolidinylmethyl)-2-furancarboxamide IUPAC Name: N-[3-(2,5-dimethylphenoxy)-5-nitrophenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[3-(2,5-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(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCC4

Isomeric SMILES

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

InChI

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