(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-tert-butylbenzoate

Systemtic Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-tert-butylbenzoate Openeye Name: [5-(2-thienyl)isoxazol-3-yl]methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester IUPAC Name: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid [5-(2-thienyl)isoxazol-3-yl]methyl ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NOC(=C2)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=NOC(=C2)C3=CC=CS3

InChI

InChI=1S/C19H19NO3S/c1-19(2,3)14-8-6-13(7-9-14)18(21)22-12-15-11-16(23-20-15)17-5-4-10-24-17/h4-11H,12H2,1-3H3