(3-ethanoyl-4-methoxycarbonyl-phenyl)methyl-triphenyl-phosphanium

Systemtic Name: (3-ethanoyl-4-methoxycarbonyl-phenyl)methyl-triphenyl-phosphanium Openeye Name: (3-acetyl-4-methoxycarbonyl-phenyl)methyl-triphenyl-phosphonium CAS Name: (3-acetyl-4-methoxycarbonylphenyl)methyl-triphenylphosphonium IUPAC Name: (3-acetyl-4-methoxycarbonylphenyl)methyl-triphenylphosphanium Traditional Name: (3-acetyl-4-carbomethoxy-benzyl)-triphenyl-phosphonium Formula: C29H26O3P+ MolecularWeight: 453.488701

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H26O3P/c1-22(30)28-20-23(18-19-27(28)29(31)32-2)21-33(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-20H,21H2,1-2H3/q+1