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

Systemtic Name: 4-chloranyl-3-methyl-phenolate; ethyl(triphenyl)phosphanium Openeye Name: 4-chloro-3-methyl-phenolate; ethyl(triphenyl)phosphonium CAS Name: 4-chloro-3-methylphenolate; ethyl(triphenyl)phosphonium IUPAC Name: 4-chloro-3-methylphenolate; ethyl(triphenyl)phosphanium Traditional Name: 4-chloro-3-methyl-phenolate; ethyl(triphenyl)phosphonium Formula: C27H26ClOP MolecularWeight: 432.921501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20P.C7H7ClO/c1-2-21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;1-5-4-6(9)2-3-7(5)8/h3-17H,2H2,1H3;2-4,9H,1H3/q+1;/p-1