ethyl 3-methyl-5-nitro-2-oxidanylidene-6-(pyrimidin-4-ylcarbonylamino)-1H-indole-3-carboxylate

Systemtic Name: ethyl 3-methyl-5-nitro-2-oxidanylidene-6-(pyrimidin-4-ylcarbonylamino)-1H-indole-3-carboxylate Openeye Name: ethyl 3-methyl-5-nitro-2-oxo-6-(pyrimidine-4-carbonylamino)indoline-3-carboxylate CAS Name: 3-methyl-5-nitro-2-oxo-6-[[oxo(4-pyrimidinyl)methyl]amino]-1H-indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-nitro-2-oxo-6-(pyrimidine-4-carbonylamino)-1H-indole-3-carboxylate Traditional Name: 2-keto-3-methyl-5-nitro-6-(pyrimidine-4-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=NC=NC=C3)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

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