(E)-2-benzamido-3-triphenylphosphaniumyl-prop-2-enoate

Systemtic Name: (E)-2-benzamido-3-triphenylphosphaniumyl-prop-2-enoate Openeye Name: (E)-2-benzamido-3-triphenylphosphaniumyl-prop-2-enoate CAS Name: (E)-2-benzamido-3-triphenylphosphiniumyl-2-propenoate IUPAC Name: (E)-2-benzamido-3-triphenylphosphaniumylprop-2-enoate Traditional Name: (E)-2-benzamido-3-triphenylphosphiniumyl-acrylate Formula: C28H22NO3P MolecularWeight: 451.452941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)[O-]

InChI

InChI=1S/C28H22NO3P/c30-27(22-13-5-1-6-14-22)29-26(28(31)32)21-33(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H,(H-,29,30,31,32)/b26-21+