3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea

Systemtic Name: 3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea Openeye Name: 3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea CAS Name: 3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea IUPAC Name: 3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea Traditional Name: 3-(4-chlorophenyl)-1,1-bis(cyanomethyl)urea Formula: C11H9ClN4O MolecularWeight: 248.66836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)N(CC#N)CC#N)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)N(CC#N)CC#N)Cl

InChI

InChI=1S/C11H9ClN4O/c12-9-1-3-10(4-2-9)15-11(17)16(7-5-13)8-6-14/h1-4H,7-8H2,(H,15,17)