N-[4-(butanoylamino)phenyl]-5-(2-methoxy-4-nitro-phenyl)furan-2-carboxamide

Systemtic Name: N-[4-(butanoylamino)phenyl]-5-(2-methoxy-4-nitro-phenyl)furan-2-carboxamide Openeye Name: N-[4-(butanoylamino)phenyl]-5-(2-methoxy-4-nitro-phenyl)furan-2-carboxamide CAS Name: 5-(2-methoxy-4-nitrophenyl)-N-[4-(1-oxobutylamino)phenyl]-2-furancarboxamide IUPAC Name: N-[4-(butanoylamino)phenyl]-5-(2-methoxy-4-nitrophenyl)furan-2-carboxamide Traditional Name: N-(4-butyramidophenyl)-5-(2-methoxy-4-nitro-phenyl)-2-furamide Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H21N3O6/c1-3-4-21(26)23-14-5-7-15(8-6-14)24-22(27)19-12-11-18(31-19)17-10-9-16(25(28)29)13-20(17)30-2/h5-13H,3-4H2,1-2H3,(H,23,26)(H,24,27)