ethyl 2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-2-[(4-nitrophenyl)amino]ethanoate

Systemtic Name: ethyl 2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-2-[(4-nitrophenyl)amino]ethanoate Openeye Name: ethyl 2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-2-(4-nitroanilino)acetate CAS Name: 2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-2-(4-nitroanilino)acetic acid ethyl ester IUPAC Name: ethyl 2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]-2-(4-nitroanilino)acetate Traditional Name: 2-[carbethoxy-(carbethoxyamino)amino]-2-(4-nitroanilino)acetic acid ethyl ester Formula: C16H22N4O8 MolecularWeight: 398.36788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(NC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)OCC)NC(=O)OCC

Isomeric SMILES

CCOC(=O)C(NC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)OCC)NC(=O)OCC

InChI

InChI=1S/C16H22N4O8/c1-4-26-14(21)13(17-11-7-9-12(10-8-11)20(24)25)19(16(23)28-6-3)18-15(22)27-5-2/h7-10,13,17H,4-6H2,1-3H3,(H,18,22)