4-chloranyl-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide; ethanoic acid

Systemtic Name: 4-chloranyl-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide; ethanoic acid Openeye Name: acetic acid; 4-chloro-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide CAS Name: acetic acid; 4-chloro-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide IUPAC Name: acetic acid; 4-chloro-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide Traditional Name: acetic acid; 4-chloro-N-[1-(1H-indol-3-yl)propyl]benzenesulfonamide Formula: C19H21ClN2O4S MolecularWeight: 408.89904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CNC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)Cl.CC(=O)O

Isomeric SMILES

CCC(C1=CNC2=CC=CC=C21)NS(=O)(=O)C3=CC=C(C=C3)Cl.CC(=O)O

InChI

InChI=1S/C17H17ClN2O2S.C2H4O2/c1-2-16(15-11-19-17-6-4-3-5-14(15)17)20-23(21,22)13-9-7-12(18)8-10-13;1-2(3)4/h3-11,16,19-20H,2H2,1H3;1H3,(H,3,4)