[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [5-(2-chloro-4-nitro-phenyl)-2-furyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [5-(2-chloro-4-nitrophenyl)-2-furanyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [5-(2-chloro-4-nitrophenyl)furan-2-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [5-(2-chloro-4-nitro-phenyl)-2-furyl]-(4-tosylpiperazino)methanone Formula: C22H20ClN3O6S MolecularWeight: 489.9287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H20ClN3O6S/c1-15-2-5-17(6-3-15)33(30,31)25-12-10-24(11-13-25)22(27)21-9-8-20(32-21)18-7-4-16(26(28)29)14-19(18)23/h2-9,14H,10-13H2,1H3