[methoxycarbonyl-[methoxycarbonyl(sulfo)amino]amino]-triphenyl-phosphanium

Systemtic Name: [methoxycarbonyl-[methoxycarbonyl(sulfo)amino]amino]-triphenyl-phosphanium Openeye Name: [methoxycarbonyl-[methoxycarbonyl(sulfo)amino]amino]-triphenyl-phosphonium CAS Name: [methoxycarbonyl-[methoxycarbonyl(sulfo)amino]amino]-triphenylphosphonium IUPAC Name: [methoxycarbonyl-[methoxycarbonyl(sulfo)amino]amino]-triphenylphosphanium Traditional Name: [carbomethoxy-[carbomethoxy(sulfo)amino]amino]-triphenyl-phosphonium Formula: C22H22N2O7PS+ MolecularWeight: 489.458041

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N2O7PS/c1-30-21(25)23(24(22(26)31-2)33(27,28)29)32(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3/p+1