4-chloranyl-3-methyl-phenolate; triphenyl-(phenylmethyl)phosphanium

Systemtic Name: 4-chloranyl-3-methyl-phenolate; triphenyl-(phenylmethyl)phosphanium Openeye Name: benzyl(triphenyl)phosphonium; 4-chloro-3-methyl-phenolate CAS Name: 4-chloro-3-methylphenolate; triphenyl-(phenylmethyl)phosphonium IUPAC Name: benzyl(triphenyl)phosphanium; 4-chloro-3-methylphenolate Traditional Name: benzyl(triphenyl)phosphonium; 4-chloro-3-methyl-phenolate Formula: C32H28ClOP MolecularWeight: 494.990881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[O-])Cl.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)[O-])Cl.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22P.C7H7ClO/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-5-4-6(9)2-3-7(5)8/h1-20H,21H2;2-4,9H,1H3/q+1;/p-1