methyl 4-[5-(4-pentoxyphenyl)-1,2-oxazol-3-yl]benzoate

Systemtic Name: methyl 4-[5-(4-pentoxyphenyl)-1,2-oxazol-3-yl]benzoate Openeye Name: methyl 4-[5-(4-pentoxyphenyl)isoxazol-3-yl]benzoate CAS Name: 4-[5-(4-pentoxyphenyl)-3-isoxazolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(4-pentoxyphenyl)-1,2-oxazol-3-yl]benzoate Traditional Name: 4-[5-(4-amoxyphenyl)isoxazol-3-yl]benzoic acid methyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC(=NO2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H23NO4/c1-3-4-5-14-26-19-12-10-17(11-13-19)21-15-20(23-27-21)16-6-8-18(9-7-16)22(24)25-2/h6-13,15H,3-5,14H2,1-2H3