tert-butyl 2-methyl-5-nitro-1H-indole-3-carboxylate

Systemtic Name: tert-butyl 2-methyl-5-nitro-1H-indole-3-carboxylate Openeye Name: tert-butyl 2-methyl-5-nitro-1H-indole-3-carboxylate CAS Name: 2-methyl-5-nitro-1H-indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-5-nitro-1H-indole-3-carboxylate Traditional Name: 2-methyl-5-nitro-1H-indole-3-carboxylic acid tert-butyl ester Formula: C14H16N2O4 MolecularWeight: 276.28784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C14H16N2O4/c1-8-12(13(17)20-14(2,3)4)10-7-9(16(18)19)5-6-11(10)15-8/h5-7,15H,1-4H3