2-(6-chloranyl-3-methanethioyl-1H-indol-5-yl)ethanoic acid

Systemtic Name: 2-(6-chloranyl-3-methanethioyl-1H-indol-5-yl)ethanoic acid Openeye Name: 2-(6-chloro-3-methanethioyl-1H-indol-5-yl)acetic acid CAS Name: 2-(6-chloro-3-methanethioyl-1H-indol-5-yl)acetic acid IUPAC Name: 2-(6-chloro-3-methanethioyl-1H-indol-5-yl)acetic acid Traditional Name: 2-(6-chloro-3-thioformyl-1H-indol-5-yl)acetic acid Formula: C11H8ClNO2S MolecularWeight: 253.70472

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1CC(=O)O)Cl)NC=C2C=S

Isomeric SMILES

C1=C2C(=CC(=C1CC(=O)O)Cl)NC=C2C=S

InChI

InChI=1S/C11H8ClNO2S/c12-9-3-10-8(7(5-16)4-13-10)1-6(9)2-11(14)15/h1,3-5,13H,2H2,(H,14,15)