butyl(triphenyl)phosphanium; 2-chloranylbenzoate

Systemtic Name: butyl(triphenyl)phosphanium; 2-chloranylbenzoate Openeye Name: butyl(triphenyl)phosphonium; 2-chlorobenzoate CAS Name: butyl(triphenyl)phosphonium; 2-chlorobenzoate IUPAC Name: butyl(triphenyl)phosphanium; 2-chlorobenzoate Traditional Name: butyl(triphenyl)phosphonium; 2-chlorobenzoate Formula: C29H28ClO2P MolecularWeight: 474.958181

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C(=C1)C(=O)[O-])Cl

Isomeric SMILES

CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C(=C1)C(=O)[O-])Cl

InChI

InChI=1S/C22H24P.C7H5ClO2/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;8-6-4-2-1-3-5(6)7(9)10/h4-18H,2-3,19H2,1H3;1-4H,(H,9,10)/q+1;/p-1