1-(5-chloranyl-4-methyl-2-pentoxy-phenyl)sulfonyl-4-(4-fluorophenyl)piperazine

Systemtic Name: 1-(5-chloranyl-4-methyl-2-pentoxy-phenyl)sulfonyl-4-(4-fluorophenyl)piperazine Openeye Name: 1-(5-chloro-4-methyl-2-pentoxy-phenyl)sulfonyl-4-(4-fluorophenyl)piperazine CAS Name: 1-(5-chloro-4-methyl-2-pentoxyphenyl)sulfonyl-4-(4-fluorophenyl)piperazine IUPAC Name: 1-(5-chloro-4-methyl-2-pentoxyphenyl)sulfonyl-4-(4-fluorophenyl)piperazine Traditional Name: 1-(2-amoxy-5-chloro-4-methyl-phenyl)sulfonyl-4-(4-fluorophenyl)piperazine Formula: C22H28ClFN2O3S MolecularWeight: 454.985723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C(=C1)C)Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCOC1=C(C=C(C(=C1)C)Cl)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H28ClFN2O3S/c1-3-4-5-14-29-21-15-17(2)20(23)16-22(21)30(27,28)26-12-10-25(11-13-26)19-8-6-18(24)7-9-19/h6-9,15-16H,3-5,10-14H2,1-2H3