ethyl 6-(butanoylamino)-3-methyl-5-nitro-2-oxidanylidene-1H-indole-3-carboxylate

Systemtic Name: ethyl 6-(butanoylamino)-3-methyl-5-nitro-2-oxidanylidene-1H-indole-3-carboxylate Openeye Name: ethyl 6-(butanoylamino)-3-methyl-5-nitro-2-oxo-indoline-3-carboxylate CAS Name: 3-methyl-5-nitro-2-oxo-6-(1-oxobutylamino)-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(butanoylamino)-3-methyl-5-nitro-2-oxo-1H-indole-3-carboxylate Traditional Name: 6-butyramido-2-keto-3-methyl-5-nitro-indoline-3-carboxylic acid ethyl ester Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=C2C(=C1)NC(=O)C2(C)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=C(C=C2C(=C1)NC(=O)C2(C)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O6/c1-4-6-13(20)17-11-8-10-9(7-12(11)19(23)24)16(3,14(21)18-10)15(22)25-5-2/h7-8H,4-6H2,1-3H3,(H,17,20)(H,18,21)