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

Systemtic Name: 2-oxidanylidenepropyl 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: acetonyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid acetonyl ester Formula: C16H20N2O6S MolecularWeight: 368.4048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O6S/c1-12(19)11-24-16(21)14-4-3-5-15(10-14)25(22,23)18-8-6-17(7-9-18)13(2)20/h3-5,10H,6-9,11H2,1-2H3