N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-5-(2-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-5-(2-nitrophenyl)furan-2-carboxamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-5-(2-nitrophenyl)furan-2-carboxamide CAS Name: N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-5-(2-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-5-(2-nitrophenyl)furan-2-carboxamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-5-(2-nitrophenyl)-2-furamide Formula: C25H25ClN4O5 MolecularWeight: 496.9428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-])Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-])Cl

InChI

InChI=1S/C25H25ClN4O5/c1-2-5-24(31)29-14-12-28(13-15-29)21-9-8-17(16-19(21)26)27-25(32)23-11-10-22(35-23)18-6-3-4-7-20(18)30(33)34/h3-4,6-11,16H,2,5,12-15H2,1H3,(H,27,32)