methyl 4-[(5S)-5-pentyl-4,5-dihydro-1,2-oxazol-3-yl]benzoate

Systemtic Name: methyl 4-[(5S)-5-pentyl-4,5-dihydro-1,2-oxazol-3-yl]benzoate Openeye Name: methyl 4-[(5S)-5-pentyl-4,5-dihydroisoxazol-3-yl]benzoate CAS Name: 4-[(5S)-5-pentyl-4,5-dihydroisoxazol-3-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5S)-5-pentyl-4,5-dihydro-1,2-oxazol-3-yl]benzoate Traditional Name: 4-[(5S)-5-amyl-2-isoxazolin-3-yl]benzoic acid methyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(=NO1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCC[C@H]1CC(=NO1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H21NO3/c1-3-4-5-6-14-11-15(17-20-14)12-7-9-13(10-8-12)16(18)19-2/h7-10,14H,3-6,11H2,1-2H3/t14-/m0/s1