2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl benzoate

Systemtic Name: 2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl benzoate Openeye Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl benzoate CAS Name: benzoic acid 2-[4-(benzenesulfonyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl benzoate Traditional Name: benzoic acid 2-(4-besylpiperazino)ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCOC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O4S/c22-19(17-7-3-1-4-8-17)25-16-15-20-11-13-21(14-12-20)26(23,24)18-9-5-2-6-10-18/h1-10H,11-16H2