1-[(3-bromophenyl)methyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine Openeye Name: 1-[(3-bromophenyl)methyl]-4-tetralin-6-ylsulfonyl-piperazine CAS Name: 1-[(3-bromophenyl)methyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine IUPAC Name: 1-[(3-bromophenyl)methyl]-4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine Traditional Name: 1-(3-bromobenzyl)-4-tetralin-6-ylsulfonyl-piperazine Formula: C21H25BrN2O2S MolecularWeight: 449.4044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C21H25BrN2O2S/c22-20-7-3-4-17(14-20)16-23-10-12-24(13-11-23)27(25,26)21-9-8-18-5-1-2-6-19(18)15-21/h3-4,7-9,14-15H,1-2,5-6,10-13,16H2