4-bromanyl-3-[4-[(E)-3-(4-bromophenyl)prop-2-enoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 4-bromanyl-3-[4-[(E)-3-(4-bromophenyl)prop-2-enoyl]phenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-bromo-3-[4-[(E)-3-(4-bromophenyl)prop-2-enoyl]phenyl]oxadiazol-3-ium-5-olate CAS Name: 4-bromo-3-[4-[(E)-3-(4-bromophenyl)-1-oxoprop-2-enyl]phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 4-bromo-3-[4-[(E)-3-(4-bromophenyl)prop-2-enoyl]phenyl]oxadiazol-3-ium-5-olate Traditional Name: 4-bromo-3-[4-[(E)-3-(4-bromophenyl)acryloyl]phenyl]oxadiazol-3-ium-5-olate Formula: C17H10Br2N2O3 MolecularWeight: 450.0809

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)[N+]3=NOC(=C3Br)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)C2=CC=C(C=C2)[N+]3=NOC(=C3Br)[O-])Br

InChI

InChI=1S/C17H10Br2N2O3/c18-13-6-1-11(2-7-13)3-10-15(22)12-4-8-14(9-5-12)21-16(19)17(23)24-20-21/h1-10H/b10-3+