diethyl 2-(2-nitro-1H-indol-3-yl)propanedioate

Systemtic Name: diethyl 2-(2-nitro-1H-indol-3-yl)propanedioate Openeye Name: diethyl 2-(2-nitro-1H-indol-3-yl)propanedioate CAS Name: 2-(2-nitro-1H-indol-3-yl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2-nitro-1H-indol-3-yl)propanedioate Traditional Name: 2-(2-nitro-1H-indol-3-yl)malonic acid diethyl ester Formula: C15H16N2O6 MolecularWeight: 320.29734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(NC2=CC=CC=C21)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=C(NC2=CC=CC=C21)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H16N2O6/c1-3-22-14(18)12(15(19)23-4-2)11-9-7-5-6-8-10(9)16-13(11)17(20)21/h5-8,12,16H,3-4H2,1-2H3