1-[1-(4-nitrophenyl)pentan-3-yl]urea

Systemtic Name: 1-[1-(4-nitrophenyl)pentan-3-yl]urea Openeye Name: [1-ethyl-3-(4-nitrophenyl)propyl]urea CAS Name: 1-(4-nitrophenyl)pentan-3-ylurea IUPAC Name: 1-(4-nitrophenyl)pentan-3-ylurea Traditional Name: [1-ethyl-3-(4-nitrophenyl)propyl]urea Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N

Isomeric SMILES

CCC(CCC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)N

InChI

InChI=1S/C12H17N3O3/c1-2-10(14-12(13)16)6-3-9-4-7-11(8-5-9)15(17)18/h4-5,7-8,10H,2-3,6H2,1H3,(H3,13,14,16)