[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-(phenylsulfonylmethyl)furan-2-yl]methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-[3-(phenylsulfonylmethyl)furan-2-yl]methanone Openeye Name: [3-(benzenesulfonylmethyl)-2-furyl]-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: [3-(benzenesulfonylmethyl)-2-furanyl]-[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-(benzenesulfonylmethyl)furan-2-yl]-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [3-(besylmethyl)-2-furyl]-[4-(4-chloro-2-nitro-phenyl)piperazino]methanone Formula: C22H20ClN3O6S MolecularWeight: 489.9287

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)C3=C(C=CO3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O6S/c23-17-6-7-19(20(14-17)26(28)29)24-9-11-25(12-10-24)22(27)21-16(8-13-32-21)15-33(30,31)18-4-2-1-3-5-18/h1-8,13-14H,9-12,15H2