ethyl 7-bromanyl-5-methylsulfonyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 7-bromanyl-5-methylsulfonyl-1H-indole-2-carboxylate Openeye Name: ethyl 7-bromo-5-methylsulfonyl-1H-indole-2-carboxylate CAS Name: 7-bromo-5-methylsulfonyl-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-bromo-5-methylsulfonyl-1H-indole-2-carboxylate Traditional Name: 7-bromo-5-mesyl-1H-indole-2-carboxylic acid ethyl ester Formula: C12H12BrNO4S MolecularWeight: 346.19698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CC(=CC(=C2N1)Br)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC2=CC(=CC(=C2N1)Br)S(=O)(=O)C

InChI

InChI=1S/C12H12BrNO4S/c1-3-18-12(15)10-5-7-4-8(19(2,16)17)6-9(13)11(7)14-10/h4-6,14H,3H2,1-2H3