ethyl 4-[4-[2-(6-methyl-1-benzofuran-3-yl)ethanoyl]piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[2-(6-methyl-1-benzofuran-3-yl)ethanoyl]piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-[2-(6-methylbenzofuran-3-yl)acetyl]piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[2-(6-methyl-3-benzofuranyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(6-methyl-1-benzofuran-3-yl)acetyl]piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-[2-(6-methylbenzofuran-3-yl)acetyl]piperazino]sulfonylbenzoic acid ethyl ester Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=COC4=C3C=CC(=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=COC4=C3C=CC(=C4)C

InChI

InChI=1S/C24H26N2O6S/c1-3-31-24(28)18-5-7-20(8-6-18)33(29,30)26-12-10-25(11-13-26)23(27)15-19-16-32-22-14-17(2)4-9-21(19)22/h4-9,14,16H,3,10-13,15H2,1-2H3