ethyl 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzoate Openeye Name: ethyl 4-[4-(p-tolylsulfonyl)piperazin-1-yl]benzoate CAS Name: 4-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzoate Traditional Name: 4-(4-tosylpiperazino)benzoic acid ethyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H24N2O4S/c1-3-26-20(23)17-6-8-18(9-7-17)21-12-14-22(15-13-21)27(24,25)19-10-4-16(2)5-11-19/h4-11H,3,12-15H2,1-2H3