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

Systemtic Name: 4-[(E)-3-(4-methylphenyl)prop-2-enoyl]-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-phenyl-4-[(E)-3-(p-tolyl)prop-2-enoyl]oxadiazol-3-ium-5-olate CAS Name: 4-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]-3-phenyl-5-oxadiazol-3-iumolate IUPAC Name: 4-[(E)-3-(4-methylphenyl)prop-2-enoyl]-3-phenyloxadiazol-3-ium-5-olate Traditional Name: 3-phenyl-4-[(E)-3-(p-tolyl)acryloyl]oxadiazol-3-ium-5-olate Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C2=C(ON=[N+]2C3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C2=C(ON=[N+]2C3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H14N2O3/c1-13-7-9-14(10-8-13)11-12-16(21)17-18(22)23-19-20(17)15-5-3-2-4-6-15/h2-12H,1H3/b12-11+