methyl 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: methyl 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[4-(4-tert-butylphenyl)sulfonylpiperazino]acetic acid methyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)OC

InChI

InChI=1S/C17H26N2O4S/c1-17(2,3)14-5-7-15(8-6-14)24(21,22)19-11-9-18(10-12-19)13-16(20)23-4/h5-8H,9-13H2,1-4H3