ethyl 3,4-dinitro-1H-indole-2-carboxylate

Systemtic Name: ethyl 3,4-dinitro-1H-indole-2-carboxylate Openeye Name: ethyl 3,4-dinitro-1H-indole-2-carboxylate CAS Name: 3,4-dinitro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,4-dinitro-1H-indole-2-carboxylate Traditional Name: 3,4-dinitro-1H-indole-2-carboxylic acid ethyl ester Formula: C11H9N3O6 MolecularWeight: 279.20566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O6/c1-2-20-11(15)9-10(14(18)19)8-6(12-9)4-3-5-7(8)13(16)17/h3-5,12H,2H2,1H3