1-[(3-bromophenyl)methyl]-4-naphthalen-2-ylsulfonyl-piperazine

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-naphthalen-2-ylsulfonyl-piperazine Openeye Name: 1-[(3-bromophenyl)methyl]-4-(2-naphthylsulfonyl)piperazine CAS Name: 1-[(3-bromophenyl)methyl]-4-(2-naphthalenylsulfonyl)piperazine IUPAC Name: 1-[(3-bromophenyl)methyl]-4-naphthalen-2-ylsulfonylpiperazine Traditional Name: 1-(3-bromobenzyl)-4-(2-naphthylsulfonyl)piperazine Formula: C21H21BrN2O2S MolecularWeight: 445.37264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Br)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Br)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H21BrN2O2S/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/h1-9,14-15H,10-13,16H2