(phenylmethyl) 5-butyl-3-thiophen-2-yl-3H-1,2-oxazole-2-carboxylate

Systemtic Name: (phenylmethyl) 5-butyl-3-thiophen-2-yl-3H-1,2-oxazole-2-carboxylate Openeye Name: benzyl 5-butyl-3-(2-thienyl)-3H-isoxazole-2-carboxylate CAS Name: 5-butyl-3-thiophen-2-yl-3H-isoxazole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-butyl-3-thiophen-2-yl-3H-1,2-oxazole-2-carboxylate Traditional Name: 5-butyl-3-(2-thienyl)-4-isoxazoline-2-carboxylic acid benzyl ester Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(N(O1)C(=O)OCC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CCCCC1=CC(N(O1)C(=O)OCC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C19H21NO3S/c1-2-3-10-16-13-17(18-11-7-12-24-18)20(23-16)19(21)22-14-15-8-5-4-6-9-15/h4-9,11-13,17H,2-3,10,14H2,1H3