4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylbutanoate

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylbutanoate Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylbutanoate CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]butanoate IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]sulfonylbutanoate Traditional Name: 4-[4-(3-chlorophenyl)piperazino]sulfonylbutyrate Formula: C14H18ClN2O4S- MolecularWeight: 345.82172

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)CCCC(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)S(=O)(=O)CCCC(=O)[O-]

InChI

InChI=1S/C14H19ClN2O4S/c15-12-3-1-4-13(11-12)16-6-8-17(9-7-16)22(20,21)10-2-5-14(18)19/h1,3-4,11H,2,5-10H2,(H,18,19)/p-1