ethyl N-[3,5-bis(ethoxycarbonylamino)-2,4,6-trinitro-phenyl]carbamate

Systemtic Name: ethyl N-[3,5-bis(ethoxycarbonylamino)-2,4,6-trinitro-phenyl]carbamate Openeye Name: ethyl N-[3,5-bis(ethoxycarbonylamino)-2,4,6-trinitro-phenyl]carbamate CAS Name: N-[3,5-bis(ethoxycarbonylamino)-2,4,6-trinitrophenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3,5-bis(ethoxycarbonylamino)-2,4,6-trinitrophenyl]carbamate Traditional Name: N-[3,5-bis(carbethoxyamino)-2,4,6-trinitro-phenyl]carbamic acid ethyl ester Formula: C15H18N6O12 MolecularWeight: 474.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N6O12/c1-4-31-13(22)16-7-10(19(25)26)8(17-14(23)32-5-2)12(21(29)30)9(11(7)20(27)28)18-15(24)33-6-3/h4-6H2,1-3H3,(H,16,22)(H,17,23)(H,18,24)