methyl 5-chloranyl-3-(phenylsulfonyl)-1H-indole-2-carboxylate

Systemtic Name: methyl 5-chloranyl-3-(phenylsulfonyl)-1H-indole-2-carboxylate Openeye Name: methyl 3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxylate CAS Name: 3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonyl)-5-chloro-1H-indole-2-carboxylate Traditional Name: 3-besyl-5-chloro-1H-indole-2-carboxylic acid methyl ester Formula: C16H12ClNO4S MolecularWeight: 349.78878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClNO4S/c1-22-16(19)14-15(12-9-10(17)7-8-13(12)18-14)23(20,21)11-5-3-2-4-6-11/h2-9,18H,1H3