methyl 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate CAS Name: 4-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate Traditional Name: 4-[[4-(3-chlorophenyl)sulfonylpiperazino]methyl]benzoic acid methyl ester Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClN2O4S/c1-26-19(23)16-7-5-15(6-8-16)14-21-9-11-22(12-10-21)27(24,25)18-4-2-3-17(20)13-18/h2-8,13H,9-12,14H2,1H3