(4S,5R)-4-(benzotriazol-1-ylmethyl)-5-ethoxy-3-phenyl-4,5-dihydro-1,2-oxazole

Systemtic Name: (4S,5R)-4-(benzotriazol-1-ylmethyl)-5-ethoxy-3-phenyl-4,5-dihydro-1,2-oxazole Openeye Name: (4S,5R)-4-(benzotriazol-1-ylmethyl)-5-ethoxy-3-phenyl-4,5-dihydroisoxazole CAS Name: (4S,5R)-4-(1-benzotriazolylmethyl)-5-ethoxy-3-phenyl-4,5-dihydroisoxazole IUPAC Name: (4S,5R)-4-(benzotriazol-1-ylmethyl)-5-ethoxy-3-phenyl-4,5-dihydro-1,2-oxazole Traditional Name: (4S,5R)-4-(benzotriazol-1-ylmethyl)-5-ethoxy-3-phenyl-2-isoxazoline Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(C(=NO1)C2=CC=CC=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CCO[C@H]1[C@H](C(=NO1)C2=CC=CC=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H18N4O2/c1-2-23-18-14(17(20-24-18)13-8-4-3-5-9-13)12-22-16-11-7-6-10-15(16)19-21-22/h3-11,14,18H,2,12H2,1H3/t14-,18+/m0/s1