cyanomethyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate

Systemtic Name: cyanomethyl 3-chloranyl-5-methoxy-4-propan-2-yloxy-benzoate Openeye Name: cyanomethyl 3-chloro-4-isopropoxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-propan-2-yloxybenzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-chloro-5-methoxy-4-propan-2-yloxybenzoate Traditional Name: 3-chloro-4-isopropoxy-5-methoxy-benzoic acid cyanomethyl ester Formula: C13H14ClNO4 MolecularWeight: 283.70756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC#N)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)C(=O)OCC#N)OC

InChI

InChI=1S/C13H14ClNO4/c1-8(2)19-12-10(14)6-9(7-11(12)17-3)13(16)18-5-4-15/h6-8H,5H2,1-3H3