4-[1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl]oxy-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl]oxy-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-(4-tert-butylphenyl)-1-methyl-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[1-(4-tert-butylphenyl)-1-oxopropan-2-yl]oxy-3-methoxybenzonitrile IUPAC Name: 4-[1-(4-tert-butylphenyl)-1-oxopropan-2-yl]oxy-3-methoxybenzonitrile Traditional Name: 4-[2-(4-tert-butylphenyl)-2-keto-1-methyl-ethoxy]-3-methoxy-benzonitrile Formula: C21H23NO3 MolecularWeight: 337.41222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)C#N)OC

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)OC2=C(C=C(C=C2)C#N)OC

InChI

InChI=1S/C21H23NO3/c1-14(25-18-11-6-15(13-22)12-19(18)24-5)20(23)16-7-9-17(10-8-16)21(2,3)4/h6-12,14H,1-5H3