methyl 1-(4-chlorophenyl)carbonyl-5-methylsulfonyl-indole-2-carboxylate

Systemtic Name: methyl 1-(4-chlorophenyl)carbonyl-5-methylsulfonyl-indole-2-carboxylate Openeye Name: methyl 1-(4-chlorobenzoyl)-5-methylsulfonyl-indole-2-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-5-methylsulfonyl-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-chlorobenzoyl)-5-methylsulfonylindole-2-carboxylate Traditional Name: 1-(4-chlorobenzoyl)-5-mesyl-indole-2-carboxylic acid methyl ester Formula: C18H14ClNO5S MolecularWeight: 391.82546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)S(=O)(=O)C

InChI

InChI=1S/C18H14ClNO5S/c1-25-18(22)16-10-12-9-14(26(2,23)24)7-8-15(12)20(16)17(21)11-3-5-13(19)6-4-11/h3-10H,1-2H3