methyl 5-cyano-2-methoxy-4-propoxy-benzoate

Systemtic Name: methyl 5-cyano-2-methoxy-4-propoxy-benzoate Openeye Name: methyl 5-cyano-2-methoxy-4-propoxy-benzoate CAS Name: 5-cyano-2-methoxy-4-propoxybenzoic acid methyl ester IUPAC Name: methyl 5-cyano-2-methoxy-4-propoxybenzoate Traditional Name: 5-cyano-2-methoxy-4-propoxy-benzoic acid methyl ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1C#N)C(=O)OC)OC

Isomeric SMILES

CCCOC1=CC(=C(C=C1C#N)C(=O)OC)OC

InChI

InChI=1S/C13H15NO4/c1-4-5-18-11-7-12(16-2)10(13(15)17-3)6-9(11)8-14/h6-7H,4-5H2,1-3H3