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

Systemtic Name: N-[4-[4-(5-chloranyl-2-methoxy-phenyl)carbonylpiperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[4-[4-(5-chloro-2-methoxy-benzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[4-[4-[(5-chloro-2-methoxyphenyl)-oxomethyl]-1-piperazinyl]phenyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[4-[4-(5-chloro-2-methoxybenzoyl)piperazin-1-yl]phenyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[4-[4-(5-chloro-2-methoxy-benzoyl)piperazino]phenyl]-5-(3-nitrophenyl)-2-furamide Formula: C29H25ClN4O6 MolecularWeight: 560.985

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H25ClN4O6/c1-39-26-10-5-20(30)18-24(26)29(36)33-15-13-32(14-16-33)22-8-6-21(7-9-22)31-28(35)27-12-11-25(40-27)19-3-2-4-23(17-19)34(37)38/h2-12,17-18H,13-16H2,1H3,(H,31,35)