[4-(cyanomethyl)phenyl] 3,5-dimethoxybenzoate

Systemtic Name: [4-(cyanomethyl)phenyl] 3,5-dimethoxybenzoate Openeye Name: [4-(cyanomethyl)phenyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [4-(cyanomethyl)phenyl] ester IUPAC Name: [4-(cyanomethyl)phenyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [4-(cyanomethyl)phenyl] ester Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)CC#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)CC#N)OC

InChI

InChI=1S/C17H15NO4/c1-20-15-9-13(10-16(11-15)21-2)17(19)22-14-5-3-12(4-6-14)7-8-18/h3-6,9-11H,7H2,1-2H3