4-bromanyl-3-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 4-bromanyl-3-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 4-bromo-3-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]-2H-oxadiazol-3-ium-5-one CAS Name: 4-bromo-3-[4-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 4-bromo-3-[4-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]phenyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 4-bromo-3-[4-[(E)-3-(4-methoxyphenyl)acryloyl]phenyl]-2H-oxadiazol-3-ium-5-one Formula: C18H14BrN2O4+ MolecularWeight: 402.21876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)[N+]3=C(C(=O)ON3)Br

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)[N+]3=C(C(=O)ON3)Br

InChI

InChI=1S/C18H13BrN2O4/c1-24-15-9-2-12(3-10-15)4-11-16(22)13-5-7-14(8-6-13)21-17(19)18(23)25-20-21/h2-11H,1H3/p+1/b11-4+