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

Systemtic Name: ethyl 4-[2-[4-(phenylsulfonyl)piperazin-1-yl]ethyl]benzoate Openeye Name: ethyl 4-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]benzoate CAS Name: 4-[2-[4-(benzenesulfonyl)-1-piperazinyl]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(benzenesulfonyl)piperazin-1-yl]ethyl]benzoate Traditional Name: 4-[2-(4-besylpiperazino)ethyl]benzoic acid ethyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-2-27-21(24)19-10-8-18(9-11-19)12-13-22-14-16-23(17-15-22)28(25,26)20-6-4-3-5-7-20/h3-11H,2,12-17H2,1H3