1-(4-bromanyl-3-propoxy-phenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine

Systemtic Name: 1-(4-bromanyl-3-propoxy-phenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine Openeye Name: 1-(4-bromo-3-propoxy-phenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine CAS Name: 1-(4-bromo-3-propoxyphenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine IUPAC Name: 1-(4-bromo-3-propoxyphenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine Traditional Name: 1-(4-bromo-3-propoxy-phenyl)sulfonyl-4-(2,3-dimethylphenyl)piperazine Formula: C21H27BrN2O3S MolecularWeight: 467.41968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Br

Isomeric SMILES

CCCOC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Br

InChI

InChI=1S/C21H27BrN2O3S/c1-4-14-27-21-15-18(8-9-19(21)22)28(25,26)24-12-10-23(11-13-24)20-7-5-6-16(2)17(20)3/h5-9,15H,4,10-14H2,1-3H3