1-[4-[4-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[(5-chloranyl-1-benzofuran-2-yl)carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-(5-chlorobenzofuran-2-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[(5-chloro-2-benzofuranyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5-chloro-1-benzofuran-2-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(5-chlorobenzofuran-2-carbonyl)piperazino]sulfonylphenyl]ethanone Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H19ClN2O5S/c1-14(25)15-2-5-18(6-3-15)30(27,28)24-10-8-23(9-11-24)21(26)20-13-16-12-17(22)4-7-19(16)29-20/h2-7,12-13H,8-11H2,1H3