ethyl 4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(4-tert-butylbenzoyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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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(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O5S/c1-5-31-23(28)19-8-12-21(13-9-19)32(29,30)26-16-14-25(15-17-26)22(27)18-6-10-20(11-7-18)24(2,3)4/h6-13H,5,14-17H2,1-4H3