N-(2,6-dimethylphenyl)-2-(naphthalen-2-ylsulfonylamino)ethanamide hydrate

Systemtic Name: N-(2,6-dimethylphenyl)-2-(naphthalen-2-ylsulfonylamino)ethanamide hydrate Openeye Name: N-(2,6-dimethylphenyl)-2-(2-naphthylsulfonylamino)acetamide hydrate CAS Name: N-(2,6-dimethylphenyl)-2-(2-naphthalenylsulfonylamino)acetamide hydrate IUPAC Name: N-(2,6-dimethylphenyl)-2-(naphthalen-2-ylsulfonylamino)acetamide hydrate Traditional Name: N-(2,6-dimethylphenyl)-2-(2-naphthylsulfonylamino)acetamide hydrate Formula: C20H22N2O4S MolecularWeight: 386.46468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNS(=O)(=O)C2=CC3=CC=CC=C3C=C2.O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNS(=O)(=O)C2=CC3=CC=CC=C3C=C2.O

InChI

InChI=1S/C20H20N2O3S.H2O/c1-14-6-5-7-15(2)20(14)22-19(23)13-21-26(24,25)18-11-10-16-8-3-4-9-17(16)12-18;/h3-12,21H,13H2,1-2H3,(H,22,23);1H2