[4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid

Systemtic Name: [4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid Openeye Name: [4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid CAS Name: [4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid IUPAC Name: [4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid Traditional Name: [4-ethoxy-2-(4-thiocyanatobut-2-ynyl)phenyl]carbamic acid Formula: C14H14N2O3S MolecularWeight: 290.33756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)O)CC#CCSC#N

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)O)CC#CCSC#N

InChI

InChI=1S/C14H14N2O3S/c1-2-19-12-6-7-13(16-14(17)18)11(9-12)5-3-4-8-20-10-15/h6-7,9,16H,2,5,8H2,1H3,(H,17,18)