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

Systemtic Name: ethyl 4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(4-ethylbenzoyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-ethylbenzoyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(4-ethylbenzoyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C22H26N2O5S/c1-3-17-5-7-18(8-6-17)21(25)23-13-15-24(16-14-23)30(27,28)20-11-9-19(10-12-20)22(26)29-4-2/h5-12H,3-4,13-16H2,1-2H3