5-[2-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[2-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[2-(4-benzyloxy-5-methoxy-2-nitro-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[2-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[2-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[2-(4-benzoxy-5-methoxy-2-nitro-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C20H17N3O7 MolecularWeight: 411.36488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC(=C(C=C2[N+](=O)[O-])OCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC(=C(C=C2[N+](=O)[O-])OCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H17N3O7/c1-13-20(23(26)27)17(30-21-13)9-8-15-10-18(28-2)19(11-16(15)22(24)25)29-12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3