4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazine-1-carbaldehyde

Systemtic Name: 4-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperazine-1-carbaldehyde Openeye Name: 4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazine-1-carbaldehyde CAS Name: 4-(4-bromo-2-ethylphenyl)sulfonyl-1-piperazinecarboxaldehyde IUPAC Name: 4-(4-bromo-2-ethylphenyl)sulfonylpiperazine-1-carbaldehyde Traditional Name: 4-(4-bromo-2-ethyl-phenyl)sulfonylpiperazine-1-carbaldehyde Formula: C13H17BrN2O3S MolecularWeight: 361.25468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C=O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)C=O

InChI

InChI=1S/C13H17BrN2O3S/c1-2-11-9-12(14)3-4-13(11)20(18,19)16-7-5-15(10-17)6-8-16/h3-4,9-10H,2,5-8H2,1H3