1-(4-bromanyl-3-methoxy-phenyl)sulfonyl-4-(2-methylphenyl)piperazine

Systemtic Name: 1-(4-bromanyl-3-methoxy-phenyl)sulfonyl-4-(2-methylphenyl)piperazine Openeye Name: 1-(4-bromo-3-methoxy-phenyl)sulfonyl-4-(o-tolyl)piperazine CAS Name: 1-(4-bromo-3-methoxyphenyl)sulfonyl-4-(2-methylphenyl)piperazine IUPAC Name: 1-(4-bromo-3-methoxyphenyl)sulfonyl-4-(2-methylphenyl)piperazine Traditional Name: 1-(4-bromo-3-methoxy-phenyl)sulfonyl-4-(o-tolyl)piperazine Formula: C18H21BrN2O3S MolecularWeight: 425.33994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Br)OC

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Br)OC

InChI

InChI=1S/C18H21BrN2O3S/c1-14-5-3-4-6-17(14)20-9-11-21(12-10-20)25(22,23)15-7-8-16(19)18(13-15)24-2/h3-8,13H,9-12H2,1-2H3