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

Systemtic Name: 1-(4-nitrophenyl)-3-pentan-2-yl-urea Openeye Name: 1-(1-methylbutyl)-3-(4-nitrophenyl)urea CAS Name: 1-(4-nitrophenyl)-3-pentan-2-ylurea IUPAC Name: 1-(4-nitrophenyl)-3-pentan-2-ylurea Traditional Name: 1-(1-methylbutyl)-3-(4-nitrophenyl)urea Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O3/c1-3-4-9(2)13-12(16)14-10-5-7-11(8-6-10)15(17)18/h5-9H,3-4H2,1-2H3,(H2,13,14,16)