1-[1-cyano-1-(4-nitrophenyl)ethyl]-3-(4-ethanoylphenyl)urea

Systemtic Name: 1-[1-cyano-1-(4-nitrophenyl)ethyl]-3-(4-ethanoylphenyl)urea Openeye Name: 1-(4-acetylphenyl)-3-[1-cyano-1-(4-nitrophenyl)ethyl]urea CAS Name: 1-(4-acetylphenyl)-3-[1-cyano-1-(4-nitrophenyl)ethyl]urea IUPAC Name: 1-(4-acetylphenyl)-3-[1-cyano-1-(4-nitrophenyl)ethyl]urea Traditional Name: 1-(4-acetylphenyl)-3-[1-cyano-1-(4-nitrophenyl)ethyl]urea Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)NC(C)(C#N)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)NC(C)(C#N)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4/c1-12(23)13-3-7-15(8-4-13)20-17(24)21-18(2,11-19)14-5-9-16(10-6-14)22(25)26/h3-10H,1-2H3,(H2,20,21,24)