2-isocyano-1-(5-methoxy-2-methyl-4-phenylmethoxy-phenyl)ethanol

Systemtic Name: 2-isocyano-1-(5-methoxy-2-methyl-4-phenylmethoxy-phenyl)ethanol Openeye Name: 1-(4-benzyloxy-5-methoxy-2-methyl-phenyl)-2-isocyano-ethanol CAS Name: 2-isocyano-1-(5-methoxy-2-methyl-4-phenylmethoxyphenyl)ethanol IUPAC Name: 2-isocyano-1-(5-methoxy-2-methyl-4-phenylmethoxyphenyl)ethanol Traditional Name: 1-(4-benzoxy-5-methoxy-2-methyl-phenyl)-2-isocyano-ethanol Formula: C18H19NO3 MolecularWeight: 297.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C[N+]#[C-])O)OC)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1C(C[N+]#[C-])O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3/c1-13-9-18(22-12-14-7-5-4-6-8-14)17(21-3)10-15(13)16(20)11-19-2/h4-10,16,20H,11-12H2,1,3H3