ethyl N-[2-(ethoxycarbonylamino)-4,5-dinitro-phenyl]carbamate

Systemtic Name: ethyl N-[2-(ethoxycarbonylamino)-4,5-dinitro-phenyl]carbamate Openeye Name: ethyl N-[2-(ethoxycarbonylamino)-4,5-dinitro-phenyl]carbamate CAS Name: N-[2-(ethoxycarbonylamino)-4,5-dinitrophenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(ethoxycarbonylamino)-4,5-dinitrophenyl]carbamate Traditional Name: N-[2-(carbethoxyamino)-4,5-dinitro-phenyl]carbamic acid ethyl ester Formula: C12H14N4O8 MolecularWeight: 342.26156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC(=C(C=C1NC(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)NC1=CC(=C(C=C1NC(=O)OCC)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O8/c1-3-23-11(17)13-7-5-9(15(19)20)10(16(21)22)6-8(7)14-12(18)24-4-2/h5-6H,3-4H2,1-2H3,(H,13,17)(H,14,18)