ethyl 4-[4-(3-oxidanylidenebutyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(3-oxidanylidenebutyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(3-oxobutyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-(3-oxobutyl)-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-oxobutyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(3-ketobutyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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