diethyl 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(5-acetamido-1H-indol-3-yl)methyl]malonic acid diethyl ester Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)NC(=O)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)NC(=O)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C20H25N3O6/c1-5-28-18(26)20(23-13(4)25,19(27)29-6-2)10-14-11-21-17-8-7-15(9-16(14)17)22-12(3)24/h7-9,11,21H,5-6,10H2,1-4H3,(H,22,24)(H,23,25)