[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone

Systemtic Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone Openeye Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxy-phenyl)methanone CAS Name: [4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-(3-ethoxy-4-propoxyphenyl)methanone IUPAC Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-ethoxy-4-propoxyphenyl)methanone Traditional Name: [4-(4-chlorophenyl)sulfonylpiperazino]-(3-ethoxy-4-propoxy-phenyl)methanone Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)OCC

InChI

InChI=1S/C22H27ClN2O5S/c1-3-15-30-20-10-5-17(16-21(20)29-4-2)22(26)24-11-13-25(14-12-24)31(27,28)19-8-6-18(23)7-9-19/h5-10,16H,3-4,11-15H2,1-2H3