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

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-5-(3-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/c1-2-4-24(31)29-13-11-28(12-14-29)21-8-7-18(16-20(21)26)27-25(32)23-10-9-22(35-23)17-5-3-6-19(15-17)30(33)34/h3,5-10,15-16H,2,4,11-14H2,1H3,(H,27,32)