1-[4-(4-nitrophenyl)but-3-yn-2-yl]-1-oxidanyl-urea

Systemtic Name: 1-[4-(4-nitrophenyl)but-3-yn-2-yl]-1-oxidanyl-urea Openeye Name: 1-hydroxy-1-[1-methyl-3-(4-nitrophenyl)prop-2-ynyl]urea CAS Name: 1-hydroxy-1-[4-(4-nitrophenyl)but-3-yn-2-yl]urea IUPAC Name: 1-hydroxy-1-[4-(4-nitrophenyl)but-3-yn-2-yl]urea Traditional Name: 1-hydroxy-1-[1-methyl-3-(4-nitrophenyl)prop-2-ynyl]urea Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)N)O

Isomeric SMILES

CC(C#CC1=CC=C(C=C1)[N+](=O)[O-])N(C(=O)N)O

InChI

InChI=1S/C11H11N3O4/c1-8(13(16)11(12)15)2-3-9-4-6-10(7-5-9)14(17)18/h4-8,16H,1H3,(H2,12,15)