2-(1H-indol-2-ylsulfanyl)-2-phenyl-propanoic acid

Systemtic Name: 2-(1H-indol-2-ylsulfanyl)-2-phenyl-propanoic acid Openeye Name: 2-(1H-indol-2-ylsulfanyl)-2-phenyl-propanoic acid CAS Name: 2-(1H-indol-2-ylthio)-2-phenylpropanoic acid IUPAC Name: 2-(1H-indol-2-ylsulfanyl)-2-phenylpropanoic acid Traditional Name: 2-(1H-indol-2-ylthio)-2-phenyl-propionic acid Formula: C17H15NO2S MolecularWeight: 297.3715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(=O)O)SC2=CC3=CC=CC=C3N2

Isomeric SMILES

CC(C1=CC=CC=C1)(C(=O)O)SC2=CC3=CC=CC=C3N2

InChI

InChI=1S/C17H15NO2S/c1-17(16(19)20,13-8-3-2-4-9-13)21-15-11-12-7-5-6-10-14(12)18-15/h2-11,18H,1H3,(H,19,20)