ethyl 2-[(3,5-dinitrophenyl)carbonyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(3,5-dinitrophenyl)carbonyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: ethyl 2-[(3,5-dinitrobenzoyl)-(2-ethoxy-2-oxo-ethyl)amino]acetate CAS Name: 2-[[(3,5-dinitrophenyl)-oxomethyl]-(2-ethoxy-2-oxoethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3,5-dinitrobenzoyl)-(2-ethoxy-2-oxoethyl)amino]acetate Traditional Name: 2-[(3,5-dinitrobenzoyl)-(2-ethoxy-2-keto-ethyl)amino]acetic acid ethyl ester Formula: C15H17N3O9 MolecularWeight: 383.31018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC(=O)OCC)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN(CC(=O)OCC)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O9/c1-3-26-13(19)8-16(9-14(20)27-4-2)15(21)10-5-11(17(22)23)7-12(6-10)18(24)25/h5-7H,3-4,8-9H2,1-2H3