3,5-bis(methoxycarbonyl)benzenesulfonate; triphenyl-(phenylmethyl)phosphanium

Systemtic Name: 3,5-bis(methoxycarbonyl)benzenesulfonate; triphenyl-(phenylmethyl)phosphanium Openeye Name: benzyl(triphenyl)phosphonium; 3,5-bis(methoxycarbonyl)benzenesulfonate CAS Name: 3,5-bis(methoxycarbonyl)benzenesulfonate; triphenyl-(phenylmethyl)phosphonium IUPAC Name: benzyl(triphenyl)phosphanium; 3,5-bis(methoxycarbonyl)benzenesulfonate Traditional Name: benzyl(triphenyl)phosphonium; 3,5-dicarbomethoxybesylate Formula: C35H31O7PS MolecularWeight: 626.655201

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)[O-])C(=O)OC.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22P.C10H10O7S/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15/h1-20H,21H2;3-5H,1-2H3,(H,13,14,15)/q+1;/p-1