ethyl 5-azanyl-3-methyl-6-nitro-2-oxidanylidene-1H-indole-3-carboxylate

Systemtic Name: ethyl 5-azanyl-3-methyl-6-nitro-2-oxidanylidene-1H-indole-3-carboxylate Openeye Name: ethyl 5-amino-3-methyl-6-nitro-2-oxo-indoline-3-carboxylate CAS Name: 5-amino-3-methyl-6-nitro-2-oxo-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-methyl-6-nitro-2-oxo-1H-indole-3-carboxylate Traditional Name: 5-amino-2-keto-3-methyl-6-nitro-indoline-3-carboxylic acid ethyl ester Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N)C

Isomeric SMILES

CCOC(=O)C1(C2=CC(=C(C=C2NC1=O)[N+](=O)[O-])N)C

InChI

InChI=1S/C12H13N3O5/c1-3-20-11(17)12(2)6-4-7(13)9(15(18)19)5-8(6)14-10(12)16/h4-5H,3,13H2,1-2H3,(H,14,16)