(4-cyanophenyl) 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-cyanophenyl) 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-cyanophenyl) 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoate CAS Name: 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoate Traditional Name: 4-(4-methyl-5-propyl-1,3-dioxan-2-yl)benzoic acid (4-cyanophenyl) ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC1COC(OC1C)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H23NO4/c1-3-4-19-14-25-22(26-15(19)2)18-9-7-17(8-10-18)21(24)27-20-11-5-16(13-23)6-12-20/h5-12,15,19,22H,3-4,14H2,1-2H3