3-[tert-butyl-(3-sulfophenyl)phosphanyl]benzenesulfonic acid

Systemtic Name: 3-[tert-butyl-(3-sulfophenyl)phosphanyl]benzenesulfonic acid Openeye Name: 3-[tert-butyl-(3-sulfophenyl)phosphanyl]benzenesulfonic acid CAS Name: 3-[tert-butyl-(3-sulfophenyl)phosphino]benzenesulfonic acid IUPAC Name: 3-[tert-butyl-(3-sulfophenyl)phosphanyl]benzenesulfonic acid Traditional Name: 3-[tert-butyl-(3-sulfophenyl)phosphino]besylic acid Formula: C16H19O6PS2 MolecularWeight: 402.422221

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19O6PS2/c1-16(2,3)23(12-6-4-8-14(10-12)24(17,18)19)13-7-5-9-15(11-13)25(20,21)22/h4-11H,1-3H3,(H,17,18,19)(H,20,21,22)