[4-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Systemtic Name: [4-(5-bromanyl-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Openeye Name: [4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone CAS Name: [4-(5-bromo-2-methoxyphenyl)sulfonyl-1-piperazinyl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone IUPAC Name: [4-(5-bromo-2-methoxyphenyl)sulfonylpiperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Traditional Name: [4-(5-bromo-2-methoxy-phenyl)sulfonylpiperazino]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone Formula: C20H21BrN2O6S MolecularWeight: 497.35954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C20H21BrN2O6S/c1-27-17-7-6-14(21)12-19(17)30(25,26)23-10-8-22(9-11-23)20(24)18-13-28-15-4-2-3-5-16(15)29-18/h2-7,12,18H,8-11,13H2,1H3