12-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)dodecanenitrile

Systemtic Name: 12-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)dodecanenitrile Openeye Name: 12-(4-acetyl-3-hydroxy-2-propyl-phenoxy)dodecanenitrile CAS Name: 12-(4-acetyl-3-hydroxy-2-propylphenoxy)dodecanenitrile IUPAC Name: 12-(4-acetyl-3-hydroxy-2-propylphenoxy)dodecanenitrile Traditional Name: 12-(4-acetyl-3-hydroxy-2-propyl-phenoxy)lauronitrile Formula: C23H35NO3 MolecularWeight: 373.5289

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCCCCCCC#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCCCCCCC#N

InChI

InChI=1S/C23H35NO3/c1-3-14-21-22(16-15-20(19(2)25)23(21)26)27-18-13-11-9-7-5-4-6-8-10-12-17-24/h15-16,26H,3-14,18H2,1-2H3