3-(4-octoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-(4-octoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid Openeye Name: 3-(4-octoxyphenyl)-4,5-dihydroisoxazole-5-carboxylic acid CAS Name: 3-(4-octoxyphenyl)-4,5-dihydroisoxazole-5-carboxylic acid IUPAC Name: 3-(4-octoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid Traditional Name: 3-(4-octoxyphenyl)-2-isoxazoline-5-carboxylic acid Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NOC(C2)C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NOC(C2)C(=O)O

InChI

InChI=1S/C18H25NO4/c1-2-3-4-5-6-7-12-22-15-10-8-14(9-11-15)16-13-17(18(20)21)23-19-16/h8-11,17H,2-7,12-13H2,1H3,(H,20,21)