methyl 1-[2-[2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[2-[(4-methylsulfonylphenyl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[2-(4-methylsulfonylanilino)-2-oxo-ethoxy]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[2-(4-methylsulfonylanilino)-2-oxoethoxy]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2-(4-methylsulfonylanilino)-2-oxoethoxy]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-[2-keto-2-(4-mesylanilino)ethoxy]ethyl]indole-3-carboxylic acid methyl ester Formula: C21H20N2O7S MolecularWeight: 444.4577

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)OCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H20N2O7S/c1-29-21(26)17-11-23(18-6-4-3-5-16(17)18)12-20(25)30-13-19(24)22-14-7-9-15(10-8-14)31(2,27)28/h3-11H,12-13H2,1-2H3,(H,22,24)