[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2H-chromen-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2H-chromen-3-yl)methanone Openeye Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2H-chromen-3-yl)methanone CAS Name: 2H-1-benzopyran-3-yl-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfonylpiperazin-1-yl]-(2H-chromen-3-yl)methanone Traditional Name: (4-brosylpiperazino)-(2H-chromen-3-yl)methanone Formula: C20H19BrN2O4S MolecularWeight: 463.34486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3OC2)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3OC2)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H19BrN2O4S/c21-17-5-7-18(8-6-17)28(25,26)23-11-9-22(10-12-23)20(24)16-13-15-3-1-2-4-19(15)27-14-16/h1-8,13H,9-12,14H2