1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol Openeye Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol CAS Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonyl-1-piperazinyl]-3-(4-ethylphenoxy)-2-propanol IUPAC Name: 1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]-3-(4-ethylphenoxy)propan-2-ol Traditional Name: 1-[4-(3-chloro-4-fluoro-phenyl)sulfonylpiperazino]-3-(4-ethylphenoxy)propan-2-ol Formula: C21H26ClFN2O4S MolecularWeight: 456.958543

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl)O

InChI

InChI=1S/C21H26ClFN2O4S/c1-2-16-3-5-18(6-4-16)29-15-17(26)14-24-9-11-25(12-10-24)30(27,28)19-7-8-21(23)20(22)13-19/h3-8,13,17,26H,2,9-12,14-15H2,1H3