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

Systemtic Name: methyl 5-chloranyl-1-methyl-3-(phenylsulfonyl)indole-2-carboxylate Openeye Name: methyl 3-(benzenesulfonyl)-5-chloro-1-methyl-indole-2-carboxylate CAS Name: 3-(benzenesulfonyl)-5-chloro-1-methyl-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(benzenesulfonyl)-5-chloro-1-methylindole-2-carboxylate Traditional Name: 3-besyl-5-chloro-1-methyl-indole-2-carboxylic acid methyl ester Formula: C17H14ClNO4S MolecularWeight: 363.81536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)C(=C1C(=O)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=C(C=C2)Cl)C(=C1C(=O)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H14ClNO4S/c1-19-14-9-8-11(18)10-13(14)16(15(19)17(20)23-2)24(21,22)12-6-4-3-5-7-12/h3-10H,1-2H3