ethyl 4-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(2-chlorophenyl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(2-chlorobenzoyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(2-chlorophenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-chlorobenzoyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(2-chlorobenzoyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C20H21ClN2O5S MolecularWeight: 436.90914

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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=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN2O5S/c1-2-28-20(25)15-7-9-16(10-8-15)29(26,27)23-13-11-22(12-14-23)19(24)17-5-3-4-6-18(17)21/h3-10H,2,11-14H2,1H3