2-methylpropyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: 2-methylpropyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: isobutyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid isobutyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O5S/c1-13(2)12-24-17(21)15-5-4-6-16(11-15)25(22,23)19-9-7-18(8-10-19)14(3)20/h4-6,11,13H,7-10,12H2,1-3H3