3-[(4-ethanoyl-2-ethyl-5-methoxy-phenoxy)methyl]benzenecarbonitrile

Systemtic Name: 3-[(4-ethanoyl-2-ethyl-5-methoxy-phenoxy)methyl]benzenecarbonitrile Openeye Name: 3-[(4-acetyl-2-ethyl-5-methoxy-phenoxy)methyl]benzonitrile CAS Name: 3-[(4-acetyl-2-ethyl-5-methoxyphenoxy)methyl]benzonitrile IUPAC Name: 3-[(4-acetyl-2-ethyl-5-methoxyphenoxy)methyl]benzonitrile Traditional Name: 3-[(4-acetyl-2-ethyl-5-methoxy-phenoxy)methyl]benzonitrile Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C)OC)OCC2=CC=CC(=C2)C#N

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C)OC)OCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H19NO3/c1-4-16-9-17(13(2)21)19(22-3)10-18(16)23-12-15-7-5-6-14(8-15)11-20/h5-10H,4,12H2,1-3H3