3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-2,2-dimethyl-propanoate

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-2,2-dimethyl-propanoate Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-2,2-dimethyl-propanoate CAS Name: 3-[[4-(3-chlorophenyl)-1-piperazinyl]sulfonyl]-2,2-dimethylpropanoate IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-2,2-dimethylpropanoate Traditional Name: 3-[4-(3-chlorophenyl)piperazino]sulfonyl-2,2-dimethyl-propionate Formula: C15H20ClN2O4S- MolecularWeight: 359.8483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)C(=O)[O-]

Isomeric SMILES

CC(C)(CS(=O)(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C15H21ClN2O4S/c1-15(2,14(19)20)11-23(21,22)18-8-6-17(7-9-18)13-5-3-4-12(16)10-13/h3-5,10H,6-9,11H2,1-2H3,(H,19,20)/p-1