ethyl 4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(4-methylbenzoyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-methylbenzoyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-(4-p-toluoylpiperazino)sulfonylbenzoic acid ethyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5S/c1-3-28-21(25)18-8-10-19(11-9-18)29(26,27)23-14-12-22(13-15-23)20(24)17-6-4-16(2)5-7-17/h4-11H,3,12-15H2,1-2H3