[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-16-14-21(17(2)25(16)15-20-4-3-13-30-20)22(27)24-11-9-23(10-12-24)18-5-7-19(8-6-18)26(28)29/h3-8,13-14H,9-12,15H2,1-2H3