ethyl 5-chloranyl-3-(3,5-dimethylphenyl)sulfonyl-4-fluoranyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-(3,5-dimethylphenyl)sulfonyl-4-fluoranyl-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-4-fluoro-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-4-fluoro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-4-fluoro-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(3,5-dimethylphenyl)sulfonyl-4-fluoro-1H-indole-2-carboxylic acid ethyl ester Formula: C19H17ClFNO4S MolecularWeight: 409.858983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2F)Cl)S(=O)(=O)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2F)Cl)S(=O)(=O)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C19H17ClFNO4S/c1-4-26-19(23)17-18(15-14(22-17)6-5-13(20)16(15)21)27(24,25)12-8-10(2)7-11(3)9-12/h5-9,22H,4H2,1-3H3