2-[butyl(phenyl)phosphanyl]-4-methyl-benzenesulfonic acid

Systemtic Name: 2-[butyl(phenyl)phosphanyl]-4-methyl-benzenesulfonic acid Openeye Name: 2-[butyl(phenyl)phosphanyl]-4-methyl-benzenesulfonic acid CAS Name: 2-[butyl(phenyl)phosphino]-4-methylbenzenesulfonic acid IUPAC Name: 2-[butyl(phenyl)phosphanyl]-4-methylbenzenesulfonic acid Traditional Name: 2-[butyl(phenyl)phosphino]-4-methyl-besylic acid Formula: C17H21O3PS MolecularWeight: 336.385601

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Descriptors Computed from Structure

Canonical SMILES:

CCCCP(C1=CC=CC=C1)C2=C(C=CC(=C2)C)S(=O)(=O)O

Isomeric SMILES

CCCCP(C1=CC=CC=C1)C2=C(C=CC(=C2)C)S(=O)(=O)O

InChI

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