diethyl 2-acetamido-2-[[1-(phenylsulfonyl)indol-3-yl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[1-(phenylsulfonyl)indol-3-yl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[1-(benzenesulfonyl)indol-3-yl]methyl]propanedioate CAS Name: 2-acetamido-2-[[1-(benzenesulfonyl)-3-indolyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[1-(benzenesulfonyl)indol-3-yl]methyl]propanedioate Traditional Name: 2-acetamido-2-[(1-besylindol-3-yl)methyl]malonic acid diethyl ester Formula: C24H26N2O7S MolecularWeight: 486.53744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C24H26N2O7S/c1-4-32-22(28)24(25-17(3)27,23(29)33-5-2)15-18-16-26(21-14-10-9-13-20(18)21)34(30,31)19-11-7-6-8-12-19/h6-14,16H,4-5,15H2,1-3H3,(H,25,27)