1-[bis(azanyl)methylidene]-3-tert-butyl-urea; nitrobenzene

Systemtic Name: 1-[bis(azanyl)methylidene]-3-tert-butyl-urea; nitrobenzene Openeye Name: 1-tert-butyl-3-(diaminomethylene)urea; nitrobenzene CAS Name: 1-tert-butyl-3-(diaminomethylidene)urea; nitrobenzene IUPAC Name: 1-tert-butyl-3-(diaminomethylidene)urea; nitrobenzene Traditional Name: 1-tert-butyl-3-(diaminomethylene)urea; nitrobenzene Formula: C12H19N5O3 MolecularWeight: 281.31096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N=C(N)N.C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)N=C(N)N.C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C6H14N4O.C6H5NO2/c1-6(2,3)10-5(11)9-4(7)8;8-7(9)6-4-2-1-3-5-6/h1-3H3,(H5,7,8,9,10,11);1-5H