[4-ethyl-2-(4-methylsulfonylphenoxy)cyclohexyl]methanamine

Systemtic Name: [4-ethyl-2-(4-methylsulfonylphenoxy)cyclohexyl]methanamine Openeye Name: [4-ethyl-2-(4-methylsulfonylphenoxy)cyclohexyl]methanamine CAS Name: [4-ethyl-2-(4-methylsulfonylphenoxy)cyclohexyl]methanamine IUPAC Name: [4-ethyl-2-(4-methylsulfonylphenoxy)cyclohexyl]methanamine Traditional Name: [4-ethyl-2-(4-mesylphenoxy)cyclohexyl]methylamine Formula: C16H25NO3S MolecularWeight: 311.4396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(C1)OC2=CC=C(C=C2)S(=O)(=O)C)CN

Isomeric SMILES

CCC1CCC(C(C1)OC2=CC=C(C=C2)S(=O)(=O)C)CN

InChI

InChI=1S/C16H25NO3S/c1-3-12-4-5-13(11-17)16(10-12)20-14-6-8-15(9-7-14)21(2,18)19/h6-9,12-13,16H,3-5,10-11,17H2,1-2H3