(4S,5S)-3-(4-nitrophenyl)-5-pyrrolidin-1-yl-4-(pyrrolidin-1-ylmethyl)-4,5-dihydro-1,2-oxazole

Systemtic Name: (4S,5S)-3-(4-nitrophenyl)-5-pyrrolidin-1-yl-4-(pyrrolidin-1-ylmethyl)-4,5-dihydro-1,2-oxazole Openeye Name: (4S,5S)-3-(4-nitrophenyl)-5-pyrrolidin-1-yl-4-(pyrrolidin-1-ylmethyl)-4,5-dihydroisoxazole CAS Name: (4S,5S)-3-(4-nitrophenyl)-5-(1-pyrrolidinyl)-4-(1-pyrrolidinylmethyl)-4,5-dihydroisoxazole IUPAC Name: (4S,5S)-3-(4-nitrophenyl)-5-pyrrolidin-1-yl-4-(pyrrolidin-1-ylmethyl)-4,5-dihydro-1,2-oxazole Traditional Name: (4S,5S)-3-(4-nitrophenyl)-5-pyrrolidino-4-(pyrrolidinomethyl)-2-isoxazoline Formula: C18H24N4O3 MolecularWeight: 344.40816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C(ON=C2C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

C1CCN(C1)C[C@@H]2[C@H](ON=C2C3=CC=C(C=C3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C18H24N4O3/c23-22(24)15-7-5-14(6-8-15)17-16(13-20-9-1-2-10-20)18(25-19-17)21-11-3-4-12-21/h5-8,16,18H,1-4,9-13H2/t16-,18-/m0/s1