phenyl N-cyano-N'-(2-methylbutan-2-yl)carbamimidate

Systemtic Name: phenyl N-cyano-N'-(2-methylbutan-2-yl)carbamimidate Openeye Name: 1-cyano-3-(1,1-dimethylpropyl)-2-phenyl-isourea CAS Name: N-cyano-N'-(2-methylbutan-2-yl)carbamimidic acid phenyl ester IUPAC Name: phenyl N-cyano-N'-(2-methylbutan-2-yl)carbamimidate Traditional Name: 3-tert-amyl-1-cyano-2-phenyl-isourea Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)N=C(NC#N)OC1=CC=CC=C1

Isomeric SMILES

CCC(C)(C)N=C(NC#N)OC1=CC=CC=C1

InChI

InChI=1S/C13H17N3O/c1-4-13(2,3)16-12(15-10-14)17-11-8-6-5-7-9-11/h5-9H,4H2,1-3H3,(H,15,16)