3-chloranyl-1-(2-ethyl-4-propan-2-ylsulfonyl-phenyl)piperazine

Systemtic Name: 3-chloranyl-1-(2-ethyl-4-propan-2-ylsulfonyl-phenyl)piperazine Openeye Name: 3-chloro-1-(2-ethyl-4-isopropylsulfonyl-phenyl)piperazine CAS Name: 3-chloro-1-(2-ethyl-4-propan-2-ylsulfonylphenyl)piperazine IUPAC Name: 3-chloro-1-(2-ethyl-4-propan-2-ylsulfonylphenyl)piperazine Traditional Name: 3-chloro-1-(2-ethyl-4-isopropylsulfonyl-phenyl)piperazine Formula: C15H23ClN2O2S MolecularWeight: 330.87332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)Cl

InChI

InChI=1S/C15H23ClN2O2S/c1-4-12-9-13(21(19,20)11(2)3)5-6-14(12)18-8-7-17-15(16)10-18/h5-6,9,11,15,17H,4,7-8,10H2,1-3H3