(3-bromanyl-4-methoxy-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (3-bromo-4-methoxy-phenyl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: (3-bromo-4-methoxyphenyl)-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-bromo-4-methoxyphenyl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (3-bromo-4-methoxy-phenyl)-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C22H21BrN2O4S MolecularWeight: 489.38214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C22H21BrN2O4S/c1-29-21-9-7-18(15-20(21)23)22(26)24-10-12-25(13-11-24)30(27,28)19-8-6-16-4-2-3-5-17(16)14-19/h2-9,14-15H,10-13H2,1H3