6-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]hexanenitrile

Systemtic Name: 6-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]hexanenitrile Openeye Name: 6-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propyl-phenoxy]hexanenitrile CAS Name: 6-[3-hydroxy-4-[(2-hydroxyphenyl)-oxomethyl]-2-propylphenoxy]hexanenitrile IUPAC Name: 6-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propylphenoxy]hexanenitrile Traditional Name: 6-(3-hydroxy-2-propyl-4-salicyloyl-phenoxy)hexanenitrile Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCCC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCCC#N

InChI

InChI=1S/C22H25NO4/c1-2-9-17-20(27-15-8-4-3-7-14-23)13-12-18(22(17)26)21(25)16-10-5-6-11-19(16)24/h5-6,10-13,24,26H,2-4,7-9,15H2,1H3