3,5-bis(methoxycarbonyl)benzenesulfonic acid; tributyl(hexadecyl)phosphanium

Systemtic Name: 3,5-bis(methoxycarbonyl)benzenesulfonic acid; tributyl(hexadecyl)phosphanium Openeye Name: 3,5-bis(methoxycarbonyl)benzenesulfonic acid; tributyl(hexadecyl)phosphonium CAS Name: 3,5-bis(methoxycarbonyl)benzenesulfonic acid; tributyl(hexadecyl)phosphonium IUPAC Name: 3,5-bis(methoxycarbonyl)benzenesulfonic acid; tributyl(hexadecyl)phosphanium Traditional Name: 3,5-dicarbomethoxybesylic acid; tributyl(cetyl)phosphonium Formula: C38H70O7PS+ MolecularWeight: 701.996961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.COC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.COC(=O)C1=CC(=CC(=C1)S(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C28H60P.C10H10O7S/c1-5-9-13-14-15-16-17-18-19-20-21-22-23-24-28-29(25-10-6-2,26-11-7-3)27-12-8-4;1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15/h5-28H2,1-4H3;3-5H,1-2H3,(H,13,14,15)/q+1;