1-(4-chlorophenyl)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 1-(4-chlorophenyl)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-(4-chlorophenyl)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 1-(4-chlorophenyl)-3-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-chlorophenyl)-3-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-(4-chlorophenyl)-3-(4-p-phenetylsulfonylpiperazino)propan-1-one Formula: C21H25ClN2O4S MolecularWeight: 436.9522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-2-28-19-7-9-20(10-8-19)29(26,27)24-15-13-23(14-16-24)12-11-21(25)17-3-5-18(22)6-4-17/h3-10H,2,11-16H2,1H3