1-(2-cyanopropan-2-yl)-3-(4-nitrophenyl)urea

Systemtic Name: 1-(2-cyanopropan-2-yl)-3-(4-nitrophenyl)urea Openeye Name: 1-(1-cyano-1-methyl-ethyl)-3-(4-nitrophenyl)urea CAS Name: 1-(2-cyanopropan-2-yl)-3-(4-nitrophenyl)urea IUPAC Name: 1-(2-cyanopropan-2-yl)-3-(4-nitrophenyl)urea Traditional Name: 1-(1-cyano-1-methyl-ethyl)-3-(4-nitrophenyl)urea Formula: C11H12N4O3 MolecularWeight: 248.23798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)NC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C#N)NC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O3/c1-11(2,7-12)14-10(16)13-8-3-5-9(6-4-8)15(17)18/h3-6H,1-2H3,(H2,13,14,16)