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

Systemtic Name: 4-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 4-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-3-phenyl-oxadiazol-3-ium-5-olate CAS Name: 4-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-3-phenyl-5-oxadiazol-3-iumolate IUPAC Name: 4-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-3-phenyloxadiazol-3-ium-5-olate Traditional Name: 4-[(E)-3-(4-nitrophenyl)acryloyl]-3-phenyl-oxadiazol-3-ium-5-olate Formula: C17H11N3O5 MolecularWeight: 337.28634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=NOC(=C2C(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H11N3O5/c21-15(11-8-12-6-9-14(10-7-12)20(23)24)16-17(22)25-18-19(16)13-4-2-1-3-5-13/h1-11H/b11-8+