N-methyl-N-[[3-(4-nitro-3-phenylmethoxy-phenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-phenyl-cyclohexan-1-amine

Systemtic Name: N-methyl-N-[[3-(4-nitro-3-phenylmethoxy-phenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-phenyl-cyclohexan-1-amine Openeye Name: N-[[3-(3-benzyloxy-4-nitro-phenyl)-4,5-dihydroisoxazol-5-yl]methyl]-N-methyl-4-phenyl-cyclohexanamine CAS Name: N-methyl-N-[[3-(4-nitro-3-phenylmethoxyphenyl)-4,5-dihydroisoxazol-5-yl]methyl]-4-phenyl-1-cyclohexanamine IUPAC Name: N-methyl-N-[[3-(4-nitro-3-phenylmethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-4-phenylcyclohexan-1-amine Traditional Name: [3-(3-benzoxy-4-nitro-phenyl)-2-isoxazolin-5-yl]methyl-methyl-(4-phenylcyclohexyl)amine Formula: C30H33N3O4 MolecularWeight: 499.60072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC(=NO1)C2=CC(=C(C=C2)[N+](=O)[O-])OCC3=CC=CC=C3)C4CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

CN(CC1CC(=NO1)C2=CC(=C(C=C2)[N+](=O)[O-])OCC3=CC=CC=C3)C4CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O4/c1-32(26-15-12-24(13-16-26)23-10-6-3-7-11-23)20-27-19-28(31-37-27)25-14-17-29(33(34)35)30(18-25)36-21-22-8-4-2-5-9-22/h2-11,14,17-18,24,26-27H,12-13,15-16,19-21H2,1H3