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

Systemtic Name: ethyl 3-methyl-5-nitro-2-oxidanylidene-6-(pyridazin-3-ylcarbonylamino)-1H-indole-3-carboxylate Openeye Name: ethyl 3-methyl-5-nitro-2-oxo-6-(pyridazine-3-carbonylamino)indoline-3-carboxylate CAS Name: 3-methyl-5-nitro-2-oxo-6-[[oxo(3-pyridazinyl)methyl]amino]-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-nitro-2-oxo-6-(pyridazine-3-carbonylamino)-1H-indole-3-carboxylate Traditional Name: 2-keto-3-methyl-5-nitro-6-(pyridazine-3-carbonylamino)indoline-3-carboxylic acid ethyl ester Formula: C17H15N5O6 MolecularWeight: 385.3309

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC(=C(C=C2NC1=O)NC(=O)C3=NN=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1(C2=CC(=C(C=C2NC1=O)NC(=O)C3=NN=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H15N5O6/c1-3-28-16(25)17(2)9-7-13(22(26)27)12(8-11(9)20-15(17)24)19-14(23)10-5-4-6-18-21-10/h4-8H,3H2,1-2H3,(H,19,23)(H,20,24)