1-[[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]methyl]azetidine-3-carbonitrile

Systemtic Name: 1-[[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]methyl]azetidine-3-carbonitrile Openeye Name: 1-[[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]phenyl]methyl]azetidine-3-carbonitrile CAS Name: 1-[[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]methyl]-3-azetidinecarbonitrile IUPAC Name: 1-[[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]methyl]azetidine-3-carbonitrile Traditional Name: 1-[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]benzyl]azetidine-3-carbonitrile Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)CN3CC(C3)C#N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)CN3CC(C3)C#N

InChI

InChI=1S/C23H26N2O3/c1-3-5-21-22(9-8-20(16(2)26)23(21)27)28-15-18-7-4-6-17(10-18)12-25-13-19(11-24)14-25/h4,6-10,19,27H,3,5,12-15H2,1-2H3