4-[(4S,5S)-4-(benzotriazol-1-ylmethyl)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]morpholine

Systemtic Name: 4-[(4S,5S)-4-(benzotriazol-1-ylmethyl)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]morpholine Openeye Name: 4-[(4S,5S)-4-(benzotriazol-1-ylmethyl)-3-phenyl-4,5-dihydroisoxazol-5-yl]morpholine CAS Name: 4-[(4S,5S)-4-(1-benzotriazolylmethyl)-3-phenyl-4,5-dihydroisoxazol-5-yl]morpholine IUPAC Name: 4-[(4S,5S)-4-(benzotriazol-1-ylmethyl)-3-phenyl-4,5-dihydro-1,2-oxazol-5-yl]morpholine Traditional Name: 4-[(4S,5S)-4-(benzotriazol-1-ylmethyl)-3-phenyl-2-isoxazolin-5-yl]morpholine Formula: C20H21N5O2 MolecularWeight: 363.41304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2C(C(=NO2)C3=CC=CC=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1COCCN1[C@@H]2[C@H](C(=NO2)C3=CC=CC=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C20H21N5O2/c1-2-6-15(7-3-1)19-16(20(27-22-19)24-10-12-26-13-11-24)14-25-18-9-5-4-8-17(18)21-23-25/h1-9,16,20H,10-14H2/t16-,20-/m0/s1