(4-cyanophenyl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (4-cyanophenyl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: (4-cyanophenyl)methyl 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)benzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid (4-cyanobenzyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)C#N)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)C#N)OCC(C)C

InChI

InChI=1S/C21H23NO4/c1-4-24-20-11-18(9-10-19(20)25-13-15(2)3)21(23)26-14-17-7-5-16(12-22)6-8-17/h5-11,15H,4,13-14H2,1-3H3