5-[(2S)-hexan-2-yl]-4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[(2S)-hexan-2-yl]-4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3-methyl-1,2-oxazole Openeye Name: 4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydrooxazol-2-yl]-3-methyl-5-[(1S)-1-methylpentyl]isoxazole CAS Name: 5-[(2S)-hexan-2-yl]-4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydrooxazol-2-yl]-3-methylisoxazole IUPAC Name: 5-[(2S)-hexan-2-yl]-4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3-methyl-1,2-oxazole Traditional Name: 4-[(4S,5S)-4-(methoxymethyl)-5-phenyl-2-oxazolin-2-yl]-3-methyl-5-[(1S)-1-methylpentyl]isoxazole Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=C(C(=NO1)C)C2=NC(C(O2)C3=CC=CC=C3)COC

Isomeric SMILES

CCCC[C@H](C)C1=C(C(=NO1)C)C2=N[C@H]([C@@H](O2)C3=CC=CC=C3)COC

InChI

InChI=1S/C21H28N2O3/c1-5-6-10-14(2)19-18(15(3)23-26-19)21-22-17(13-24-4)20(25-21)16-11-8-7-9-12-16/h7-9,11-12,14,17,20H,5-6,10,13H2,1-4H3/t14-,17-,20-/m0/s1