ethyl N-[(ethoxycarbonylamino)-(3-nitrophenyl)methyl]carbamate

Systemtic Name: ethyl N-[(ethoxycarbonylamino)-(3-nitrophenyl)methyl]carbamate Openeye Name: ethyl N-[(ethoxycarbonylamino)-(3-nitrophenyl)methyl]carbamate CAS Name: N-[(ethoxycarbonylamino)-(3-nitrophenyl)methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(ethoxycarbonylamino)-(3-nitrophenyl)methyl]carbamate Traditional Name: N-[(carbethoxyamino)-(3-nitrophenyl)methyl]carbamic acid ethyl ester Formula: C13H17N3O6 MolecularWeight: 311.29058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O6/c1-3-21-12(17)14-11(15-13(18)22-4-2)9-6-5-7-10(8-9)16(19)20/h5-8,11H,3-4H2,1-2H3,(H,14,17)(H,15,18)