ethyl N-[(E)-N'-ethoxycarbonylcarbamimidoyl]-N-(4-nitrophenyl)carbamate

Systemtic Name: ethyl N-[(E)-N'-ethoxycarbonylcarbamimidoyl]-N-(4-nitrophenyl)carbamate Openeye Name: ethyl N-[(E)-N'-ethoxycarbonylcarbamimidoyl]-N-(4-nitrophenyl)carbamate CAS Name: N-[(E)-amino(ethoxycarbonylimino)methyl]-N-(4-nitrophenyl)carbamic acid ethyl ester IUPAC Name: ethyl N-[(E)-N'-ethoxycarbonylcarbamimidoyl]-N-(4-nitrophenyl)carbamate Traditional Name: N-[(E)-N'-carbethoxyamidino]-N-(4-nitrophenyl)carbamic acid ethyl ester Formula: C13H16N4O6 MolecularWeight: 324.28934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O6/c1-3-22-12(18)15-11(14)16(13(19)23-4-2)9-5-7-10(8-6-9)17(20)21/h5-8H,3-4H2,1-2H3,(H2,14,15,18)