N-[5-(butanoylamino)-2-chloranyl-phenyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[5-(butanoylamino)-2-chloranyl-phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[5-(butanoylamino)-2-chloro-phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[2-chloro-5-(1-oxobutylamino)phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[5-(butanoylamino)-2-chlorophenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-(5-butyramido-2-chloro-phenyl)-5-(3-nitrophenyl)-2-furamide Formula: C21H18ClN3O5 MolecularWeight: 427.83772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN3O5/c1-2-4-20(26)23-14-7-8-16(22)17(12-14)24-21(27)19-10-9-18(30-19)13-5-3-6-15(11-13)25(28)29/h3,5-12H,2,4H2,1H3,(H,23,26)(H,24,27)