sodium (3-butylphenyl)phosphanyl benzenesulfonate

Systemtic Name: sodium (3-butylphenyl)phosphanyl benzenesulfonate Openeye Name: sodium (3-butylphenyl)phosphanyl benzenesulfonate CAS Name: sodium benzenesulfonic acid (3-butylphenyl)phosphino ester IUPAC Name: sodium (3-butylphenyl)phosphanyl benzenesulfonate Traditional Name: sodium benzenesulfonic acid (3-butylphenyl)phosphino ester Formula: C16H19NaO3PS+ MolecularWeight: 345.348791

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)POS(=O)(=O)C2=CC=CC=C2.[Na+]

Isomeric SMILES

CCCCC1=CC(=CC=C1)POS(=O)(=O)C2=CC=CC=C2.[Na+]

InChI

InChI=1S/C16H19O3PS.Na/c1-2-3-8-14-9-7-10-15(13-14)20-19-21(17,18)16-11-5-4-6-12-16;/h4-7,9-13,20H,2-3,8H2,1H3;/q;+1