ethyl 1,3-dimethyl-5-nitro-indole-2-carboxylate

Systemtic Name: ethyl 1,3-dimethyl-5-nitro-indole-2-carboxylate Openeye Name: ethyl 1,3-dimethyl-5-nitro-indole-2-carboxylate CAS Name: 1,3-dimethyl-5-nitro-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3-dimethyl-5-nitroindole-2-carboxylate Traditional Name: 1,3-dimethyl-5-nitro-indole-2-carboxylic acid ethyl ester Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1C)C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H14N2O4/c1-4-19-13(16)12-8(2)10-7-9(15(17)18)5-6-11(10)14(12)3/h5-7H,4H2,1-3H3