propan-2-yl 5-chloranyl-1-(phenylsulfonyl)indole-3-carboxylate

Systemtic Name: propan-2-yl 5-chloranyl-1-(phenylsulfonyl)indole-3-carboxylate Openeye Name: isopropyl 1-(benzenesulfonyl)-5-chloro-indole-3-carboxylate CAS Name: 1-(benzenesulfonyl)-5-chloro-3-indolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(benzenesulfonyl)-5-chloroindole-3-carboxylate Traditional Name: 1-besyl-5-chloro-indole-3-carboxylic acid isopropyl ester Formula: C18H16ClNO4S MolecularWeight: 377.84194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN(C2=C1C=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1=CN(C2=C1C=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClNO4S/c1-12(2)24-18(21)16-11-20(17-9-8-13(19)10-15(16)17)25(22,23)14-6-4-3-5-7-14/h3-12H,1-2H3