N-[4-(diethylsulfamoyl)-2-oxidanyl-naphthalen-1-yl]benzamide hydrate

Systemtic Name: N-[4-(diethylsulfamoyl)-2-oxidanyl-naphthalen-1-yl]benzamide hydrate Openeye Name: N-[4-(diethylsulfamoyl)-2-hydroxy-1-naphthyl]benzamide hydrate CAS Name: N-[4-(diethylsulfamoyl)-2-hydroxy-1-naphthalenyl]benzamide hydrate IUPAC Name: N-[4-(diethylsulfamoyl)-2-hydroxynaphthalen-1-yl]benzamide hydrate Traditional Name: N-[4-(diethylsulfamoyl)-2-hydroxy-1-naphthyl]benzamide hydrate Formula: C21H24N2O5S MolecularWeight: 416.49066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C2=CC=CC=C21)NC(=O)C3=CC=CC=C3)O.O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C2=CC=CC=C21)NC(=O)C3=CC=CC=C3)O.O

InChI

InChI=1S/C21H22N2O4S.H2O/c1-3-23(4-2)28(26,27)19-14-18(24)20(17-13-9-8-12-16(17)19)22-21(25)15-10-6-5-7-11-15;/h5-14,24H,3-4H2,1-2H3,(H,22,25);1H2