1-(3-chlorophenyl)-4-sulfonyl-piperazin-4-ium; 9H-fluorene

Systemtic Name: 1-(3-chlorophenyl)-4-sulfonyl-piperazin-4-ium; 9H-fluorene Openeye Name: 1-(3-chlorophenyl)-4-sulfonyl-piperazin-4-ium; 9H-fluorene CAS Name: 1-(3-chlorophenyl)-4-sulfonylpiperazin-4-ium; 9H-fluorene IUPAC Name: 1-(3-chlorophenyl)-4-sulfonylpiperazin-4-ium; 9H-fluorene Traditional Name: 1-(3-chlorophenyl)-4-sulfonyl-piperazin-4-ium; fluorene Formula: C23H22ClN2O2S+ MolecularWeight: 425.95098

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=S(=O)=O)CCN1C2=CC(=CC=C2)Cl.C1C2=CC=CC=C2C3=CC=CC=C31

Isomeric SMILES

C1C[N+](=S(=O)=O)CCN1C2=CC(=CC=C2)Cl.C1C2=CC=CC=C2C3=CC=CC=C31

InChI

InChI=1S/C13H10.C10H12ClN2O2S/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12;11-9-2-1-3-10(8-9)12-4-6-13(7-5-12)16(14)15/h1-8H,9H2;1-3,8H,4-7H2/q;+1