2,4-bis(methylsulfonyl)-N-phenethyl-aniline

Systemtic Name: 2,4-bis(methylsulfonyl)-N-phenethyl-aniline Openeye Name: 2,4-bis(methylsulfonyl)-N-phenethyl-aniline CAS Name: 2,4-bis(methylsulfonyl)-N-phenethylaniline IUPAC Name: 2,4-bis(methylsulfonyl)-N-phenethylaniline Traditional Name: (2,4-dimesylphenyl)-phenethyl-amine Formula: C16H19NO4S2 MolecularWeight: 353.45636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C16H19NO4S2/c1-22(18,19)14-8-9-15(16(12-14)23(2,20)21)17-11-10-13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3