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

Systemtic Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide CAS Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-5-(1-pyrrolidinylmethyl)-2-furancarboxamide IUPAC Name: N-[3-(2-methylphenoxy)-5-nitrophenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[3-(2-methylphenoxy)-5-nitro-phenyl]-5-(pyrrolidinomethyl)-2-furamide Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCC4

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)CN4CCCC4

InChI

InChI=1S/C23H23N3O5/c1-16-6-2-3-7-21(16)31-20-13-17(12-18(14-20)26(28)29)24-23(27)22-9-8-19(30-22)15-25-10-4-5-11-25/h2-3,6-9,12-14H,4-5,10-11,15H2,1H3,(H,24,27)