ethyl 2-[(3E)-5,7-dinitro-2-oxidanylidene-3-phenylmethoxyimino-indol-1-yl]ethanoate

Systemtic Name: ethyl 2-[(3E)-5,7-dinitro-2-oxidanylidene-3-phenylmethoxyimino-indol-1-yl]ethanoate Openeye Name: ethyl 2-[(3E)-3-benzyloxyimino-5,7-dinitro-2-oxo-indolin-1-yl]acetate CAS Name: 2-[(3E)-5,7-dinitro-2-oxo-3-phenylmethoxyimino-1-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3E)-5,7-dinitro-2-oxo-3-phenylmethoxyiminoindol-1-yl]acetate Traditional Name: 2-[(3E)-3-benzyloximino-2-keto-5,7-dinitro-indolin-1-yl]acetic acid ethyl ester Formula: C19H16N4O8 MolecularWeight: 428.35234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2C(=NOCC3=CC=CC=C3)C1=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2/C(=N\OCC3=CC=CC=C3)/C1=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O8/c1-2-30-16(24)10-21-18-14(8-13(22(26)27)9-15(18)23(28)29)17(19(21)25)20-31-11-12-6-4-3-5-7-12/h3-9H,2,10-11H2,1H3/b20-17+