1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazine

Systemtic Name: 1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazine Openeye Name: 1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazine CAS Name: 1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-[(3-fluoro-4-methoxyphenyl)methyl]piperazine IUPAC Name: 1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-[(3-fluoro-4-methoxyphenyl)methyl]piperazine Traditional Name: 1-(3,4-dihydronaphthalen-2-ylsulfonyl)-4-(3-fluoro-4-methoxy-benzyl)piperazine Formula: C22H25FN2O3S MolecularWeight: 416.508903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4CC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4CC3)F

InChI

InChI=1S/C22H25FN2O3S/c1-28-22-9-6-17(14-21(22)23)16-24-10-12-25(13-11-24)29(26,27)20-8-7-18-4-2-3-5-19(18)15-20/h2-6,9,14-15H,7-8,10-13,16H2,1H3