5-[(E)-2-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]ethenyl]-3-methyl-4-nitro-1,2-oxazole

Systemtic Name: 5-[(E)-2-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[(E)-2-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[(E)-2-[3-bromo-5-methoxy-4-(2-pyridinylmethoxy)phenyl]ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[(E)-2-[3-bromo-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[(E)-2-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]vinyl]-3-methyl-4-nitro-isoxazole Formula: C19H16BrN3O5 MolecularWeight: 446.25144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC(=C(C(=C2)Br)OCC3=CC=CC=N3)OC

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC(=C(C(=C2)Br)OCC3=CC=CC=N3)OC

InChI

InChI=1S/C19H16BrN3O5/c1-12-18(23(24)25)16(28-22-12)7-6-13-9-15(20)19(17(10-13)26-2)27-11-14-5-3-4-8-21-14/h3-10H,11H2,1-2H3/b7-6+