ethyl 5-chloranyl-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-chloranyl-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylate Openeye Name: ethyl 5-chloro-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylate CAS Name: 5-chloro-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylate Traditional Name: 5-chloro-3-(cyclohexylmethylsulfonyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C18H22ClNO4S MolecularWeight: 383.88958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)S(=O)(=O)CC3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Cl)S(=O)(=O)CC3CCCCC3

InChI

InChI=1S/C18H22ClNO4S/c1-2-24-18(21)16-17(14-10-13(19)8-9-15(14)20-16)25(22,23)11-12-6-4-3-5-7-12/h8-10,12,20H,2-7,11H2,1H3