methyl (4R,5S)-3-nonyl-5-propan-2-yl-4,5-dihydro-1,2-oxazole-4-carboxylate

Systemtic Name: methyl (4R,5S)-3-nonyl-5-propan-2-yl-4,5-dihydro-1,2-oxazole-4-carboxylate Openeye Name: methyl (4R,5S)-5-isopropyl-3-nonyl-4,5-dihydroisoxazole-4-carboxylate CAS Name: (4R,5S)-3-nonyl-5-propan-2-yl-4,5-dihydroisoxazole-4-carboxylic acid methyl ester IUPAC Name: methyl (4R,5S)-3-nonyl-5-propan-2-yl-4,5-dihydro-1,2-oxazole-4-carboxylate Traditional Name: (4R,5S)-5-isopropyl-3-nonyl-2-isoxazoline-4-carboxylic acid methyl ester Formula: C17H31NO3 MolecularWeight: 297.43294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=NOC(C1C(=O)OC)C(C)C

Isomeric SMILES

CCCCCCCCCC1=NO[C@H]([C@@H]1C(=O)OC)C(C)C

InChI

InChI=1S/C17H31NO3/c1-5-6-7-8-9-10-11-12-14-15(17(19)20-4)16(13(2)3)21-18-14/h13,15-16H,5-12H2,1-4H3/t15-,16+/m1/s1