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

Systemtic Name: 5-[2-(3-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Openeye Name: 5-[2-(3-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole CAS Name: 5-[2-(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)ethenyl]-3-methyl-4-nitroisoxazole IUPAC Name: 5-[2-(3-bromo-5-methoxy-4-prop-2-ynoxyphenyl)ethenyl]-3-methyl-4-nitro-1,2-oxazole Traditional Name: 5-[2-(3-bromo-5-methoxy-4-propargyloxy-phenyl)vinyl]-3-methyl-4-nitro-isoxazole Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2O5/c1-4-7-23-16-12(17)8-11(9-14(16)22-3)5-6-13-15(19(20)21)10(2)18-24-13/h1,5-6,8-9H,7H2,2-3H3