1-(4-bromophenyl)sulfonyl-4-(4-nitro-3-piperidin-1-yl-phenyl)piperazine

Systemtic Name: 1-(4-bromophenyl)sulfonyl-4-(4-nitro-3-piperidin-1-yl-phenyl)piperazine Openeye Name: 1-(4-bromophenyl)sulfonyl-4-[4-nitro-3-(1-piperidyl)phenyl]piperazine CAS Name: 1-(4-bromophenyl)sulfonyl-4-[4-nitro-3-(1-piperidinyl)phenyl]piperazine IUPAC Name: 1-(4-bromophenyl)sulfonyl-4-(4-nitro-3-piperidin-1-ylphenyl)piperazine Traditional Name: 1-brosyl-4-(4-nitro-3-piperidino-phenyl)piperazine Formula: C21H25BrN4O4S MolecularWeight: 509.4166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H25BrN4O4S/c22-17-4-7-19(8-5-17)31(29,30)25-14-12-23(13-15-25)18-6-9-20(26(27)28)21(16-18)24-10-2-1-3-11-24/h4-9,16H,1-3,10-15H2