aminocarbonyl (1E)-N-[(4-nitrophenyl)methoxycarbonyl]pyrazole-1-carboximidate

Systemtic Name: aminocarbonyl (1E)-N-[(4-nitrophenyl)methoxycarbonyl]pyrazole-1-carboximidate Openeye Name: carbamoyl (1E)-N-[(4-nitrophenyl)methoxycarbonyl]pyrazole-1-carboximidate CAS Name: (1E)-N-[(4-nitrophenyl)methoxy-oxomethyl]-1-pyrazolecarboximidic acid carbamoyl ester IUPAC Name: carbamoyl (1E)-N-[(4-nitrophenyl)methoxycarbonyl]pyrazole-1-carboximidate Traditional Name: (1E)-N-(4-nitrobenzyl)oxycarbonylpyrazole-1-carboximidic acid carbamoyl ester Formula: C13H11N5O6 MolecularWeight: 333.25634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C(=NC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)N

Isomeric SMILES

C1=CN(N=C1)/C(=N\C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])/OC(=O)N

InChI

InChI=1S/C13H11N5O6/c14-11(19)24-12(17-7-1-6-15-17)16-13(20)23-8-9-2-4-10(5-3-9)18(21)22/h1-7H,8H2,(H2,14,19)/b16-12+