1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine

Systemtic Name: 1-[(3-bromanyl-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine Openeye Name: 1-[(3-bromo-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine CAS Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-(4-fluorophenyl)sulfonylpiperazine IUPAC Name: 1-[(3-bromo-4-methoxyphenyl)methyl]-4-(4-fluorophenyl)sulfonylpiperazine Traditional Name: 1-(3-bromo-4-methoxy-benzyl)-4-(4-fluorophenyl)sulfonyl-piperazine Formula: C18H20BrFN2O3S MolecularWeight: 443.330403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Br

InChI

InChI=1S/C18H20BrFN2O3S/c1-25-18-7-2-14(12-17(18)19)13-21-8-10-22(11-9-21)26(23,24)16-5-3-15(20)4-6-16/h2-7,12H,8-11,13H2,1H3