(4-cyanophenyl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: (4-cyanophenyl)methyl 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: (4-cyanophenyl)methyl 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid (4-cyanobenzyl) ester Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClNO4/c1-2-22-15-8-13(7-14(18)16(15)20)17(21)23-10-12-5-3-11(9-19)4-6-12/h3-8,20H,2,10H2,1H3