1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-(5-bromanyl-2-ethoxy-phenyl)sulfonyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine Openeye Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine CAS Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine IUPAC Name: 1-(5-bromo-2-ethoxyphenyl)sulfonyl-4-[(2,5-dimethoxyphenyl)methyl]piperazine Traditional Name: 1-(5-bromo-2-ethoxy-phenyl)sulfonyl-4-(2,5-dimethoxybenzyl)piperazine Formula: C21H27BrN2O5S MolecularWeight: 499.41848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H27BrN2O5S/c1-4-29-20-7-5-17(22)14-21(20)30(25,26)24-11-9-23(10-12-24)15-16-13-18(27-2)6-8-19(16)28-3/h5-8,13-14H,4,9-12,15H2,1-3H3