1-butyl-3-[4-(cyanomethoxy)phenyl]urea

Systemtic Name: 1-butyl-3-[4-(cyanomethoxy)phenyl]urea Openeye Name: 1-butyl-3-[4-(cyanomethoxy)phenyl]urea CAS Name: 1-butyl-3-[4-(cyanomethoxy)phenyl]urea IUPAC Name: 1-butyl-3-[4-(cyanomethoxy)phenyl]urea Traditional Name: 1-butyl-3-[4-(cyanomethoxy)phenyl]urea Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC1=CC=C(C=C1)OCC#N

Isomeric SMILES

CCCCNC(=O)NC1=CC=C(C=C1)OCC#N

InChI

InChI=1S/C13H17N3O2/c1-2-3-9-15-13(17)16-11-4-6-12(7-5-11)18-10-8-14/h4-7H,2-3,9-10H2,1H3,(H2,15,16,17)