3-(2-butylphenyl)phosphanyl-4-methyl-benzenesulfonic acid

Systemtic Name: 3-(2-butylphenyl)phosphanyl-4-methyl-benzenesulfonic acid Openeye Name: 3-(2-butylphenyl)phosphanyl-4-methyl-benzenesulfonic acid CAS Name: 3-(2-butylphenyl)phosphino-4-methylbenzenesulfonic acid IUPAC Name: 3-(2-butylphenyl)phosphanyl-4-methylbenzenesulfonic acid Traditional Name: 3-(2-butylphenyl)phosphino-4-methyl-besylic acid Formula: C17H21O3PS MolecularWeight: 336.385601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1PC2=C(C=CC(=C2)S(=O)(=O)O)C

Isomeric SMILES

CCCCC1=CC=CC=C1PC2=C(C=CC(=C2)S(=O)(=O)O)C

InChI

InChI=1S/C17H21O3PS/c1-3-4-7-14-8-5-6-9-16(14)21-17-12-15(22(18,19)20)11-10-13(17)2/h5-6,8-12,21H,3-4,7H2,1-2H3,(H,18,19,20)