5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one

Systemtic Name: 5-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one Openeye Name: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 5-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1,3-dimethyl-6-nitro-2-benzimidazolone IUPAC Name: 5-[4-(furan-2-carbonyl)piperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one Traditional Name: 5-[4-(2-furoyl)piperazino]-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C18H19N5O5/c1-19-12-10-14(15(23(26)27)11-13(12)20(2)18(19)25)21-5-7-22(8-6-21)17(24)16-4-3-9-28-16/h3-4,9-11H,5-8H2,1-2H3