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

Systemtic Name: 4-chloranyl-3-methyl-phenolate; methyl(triphenyl)phosphanium Openeye Name: 4-chloro-3-methyl-phenolate; methyl(triphenyl)phosphonium CAS Name: 4-chloro-3-methylphenolate; methyl(triphenyl)phosphonium IUPAC Name: 4-chloro-3-methylphenolate; methyl(triphenyl)phosphanium Traditional Name: 4-chloro-3-methyl-phenolate; methyl(triphenyl)phosphonium Formula: C26H24ClOP MolecularWeight: 418.894921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18P.C7H7ClO/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-5-4-6(9)2-3-7(5)8/h2-16H,1H3;2-4,9H,1H3/q+1;/p-1