ethyl 5-[butanoyl(ethylsulfonyl)amino]-1-ethylsulfonyl-2-methyl-indole-3-carboxylate

Systemtic Name: ethyl 5-[butanoyl(ethylsulfonyl)amino]-1-ethylsulfonyl-2-methyl-indole-3-carboxylate Openeye Name: ethyl 5-[butanoyl(ethylsulfonyl)amino]-1-ethylsulfonyl-2-methyl-indole-3-carboxylate CAS Name: 1-ethylsulfonyl-5-[ethylsulfonyl(1-oxobutyl)amino]-2-methyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[butanoyl(ethylsulfonyl)amino]-1-ethylsulfonyl-2-methylindole-3-carboxylate Traditional Name: 5-[butyryl(esyl)amino]-1-esyl-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C20H28N2O7S2 MolecularWeight: 472.57552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)S(=O)(=O)CC)S(=O)(=O)CC

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)N(C(=C2C(=O)OCC)C)S(=O)(=O)CC)S(=O)(=O)CC

InChI

InChI=1S/C20H28N2O7S2/c1-6-10-18(23)22(31(27,28)9-4)15-11-12-17-16(13-15)19(20(24)29-7-2)14(5)21(17)30(25,26)8-3/h11-13H,6-10H2,1-5H3