ethyl 5-[cyclohexylcarbonyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate

Systemtic Name: ethyl 5-[cyclohexylcarbonyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate Openeye Name: ethyl 5-[cyclohexanecarbonyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonyl-indole-3-carboxylate CAS Name: 5-[[cyclohexyl(oxo)methyl]-methylsulfonylamino]-2-methyl-1-methylsulfonyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[cyclohexanecarbonyl(methylsulfonyl)amino]-2-methyl-1-methylsulfonylindole-3-carboxylate Traditional Name: 5-[cyclohexanecarbonyl(mesyl)amino]-1-mesyl-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C21H28N2O7S2 MolecularWeight: 484.58622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)N(C(=O)C3CCCCC3)S(=O)(=O)C)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)N(C(=O)C3CCCCC3)S(=O)(=O)C)S(=O)(=O)C)C

InChI

InChI=1S/C21H28N2O7S2/c1-5-30-21(25)19-14(2)22(31(3,26)27)18-12-11-16(13-17(18)19)23(32(4,28)29)20(24)15-9-7-6-8-10-15/h11-13,15H,5-10H2,1-4H3