[4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [4-(2-bromanyl-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazin-1-yl]-(3-methoxyphenyl)methanone CAS Name: [4-(2-bromo-4,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-(3-methoxyphenyl)methanone IUPAC Name: [4-(2-bromo-4,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [4-(2-bromo-4,5-dimethoxy-phenyl)sulfonylpiperazino]-(3-methoxyphenyl)methanone Formula: C20H23BrN2O6S MolecularWeight: 499.37542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O6S/c1-27-15-6-4-5-14(11-15)20(24)22-7-9-23(10-8-22)30(25,26)19-13-18(29-3)17(28-2)12-16(19)21/h4-6,11-13H,7-10H2,1-3H3