oxan-2-yl 4-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]benzoate

Systemtic Name: oxan-2-yl 4-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]benzoate Openeye Name: tetrahydropyran-2-yl 4-[2-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]benzoate CAS Name: 4-[2-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]benzoic acid 2-oxanyl ester IUPAC Name: oxan-2-yl 4-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]benzoate Traditional Name: 4-[2-(4,4-dimethyl-2-oxazolin-2-yl)phenyl]benzoic acid tetrahydropyran-2-yl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=N1)C2=CC=CC=C2C3=CC=C(C=C3)C(=O)OC4CCCCO4)C

Isomeric SMILES

CC1(COC(=N1)C2=CC=CC=C2C3=CC=C(C=C3)C(=O)OC4CCCCO4)C

InChI

InChI=1S/C23H25NO4/c1-23(2)15-27-21(24-23)19-8-4-3-7-18(19)16-10-12-17(13-11-16)22(25)28-20-9-5-6-14-26-20/h3-4,7-8,10-13,20H,5-6,9,14-15H2,1-2H3