5-chloranyl-3-phenylsulfanyl-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-phenylsulfanyl-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-phenylsulfanyl-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-(phenylthio)-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-phenylsulfanyl-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-(phenylthio)-1H-indole-2-carboxylic acid Formula: C15H10ClNO2S MolecularWeight: 303.7634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C15H10ClNO2S/c16-9-6-7-12-11(8-9)14(13(17-12)15(18)19)20-10-4-2-1-3-5-10/h1-8,17H,(H,18,19)