N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-propyl]-4-nitro-benzenesulfonamide CAS Name: N-[3-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-[4-(4-fluorophenyl)piperazino]-3-keto-propyl]-4-nitro-benzenesulfonamide Formula: C19H21FN4O5S MolecularWeight: 436.457243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21FN4O5S/c20-15-1-3-16(4-2-15)22-11-13-23(14-12-22)19(25)9-10-21-30(28,29)18-7-5-17(6-8-18)24(26)27/h1-8,21H,9-14H2