2-[(3-chloranyl-1-benzothiophen-2-yl)methylamino]propanoic acid

Systemtic Name: 2-[(3-chloranyl-1-benzothiophen-2-yl)methylamino]propanoic acid Openeye Name: 2-[(3-chlorobenzothiophen-2-yl)methylamino]propanoic acid CAS Name: 2-[(3-chloro-1-benzothiophen-2-yl)methylamino]propanoic acid IUPAC Name: 2-[(3-chloro-1-benzothiophen-2-yl)methylamino]propanoic acid Traditional Name: 2-[(3-chlorobenzothiophen-2-yl)methylamino]propionic acid Formula: C12H12ClNO2S MolecularWeight: 269.74718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C(=O)O)NCC1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C12H12ClNO2S/c1-7(12(15)16)14-6-10-11(13)8-4-2-3-5-9(8)17-10/h2-5,7,14H,6H2,1H3,(H,15,16)