(1-methoxy-1-oxidanylidene-propan-2-yl) 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (1-methoxy-1-oxidanylidene-propan-2-yl) 3-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (2-methoxy-1-methyl-2-oxo-ethyl) 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (1-methoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-methoxy-1-oxopropan-2-yl) 3-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-acetylpiperazino)sulfonylbenzoic acid (2-keto-2-methoxy-1-methyl-ethyl) ester Formula: C17H22N2O7S MolecularWeight: 398.43078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O7S/c1-12(16(21)25-3)26-17(22)14-5-4-6-15(11-14)27(23,24)19-9-7-18(8-10-19)13(2)20/h4-6,11-12H,7-10H2,1-3H3