(3-diazanyl-3-oxidanylidene-propyl)-triphenyl-phosphanium sulfate

Systemtic Name: (3-diazanyl-3-oxidanylidene-propyl)-triphenyl-phosphanium sulfate Openeye Name: (3-hydrazino-3-oxo-propyl)-triphenyl-phosphonium sulfate CAS Name: (3-hydrazinyl-3-oxopropyl)-triphenylphosphonium sulfate IUPAC Name: (3-hydrazinyl-3-oxopropyl)-triphenylphosphanium sulfate Traditional Name: (3-hydrazino-3-keto-propyl)-triphenyl-phosphonium sulfate Formula: C42H44N4O6P2S MolecularWeight: 794.834482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCC(=O)NN)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[P+](CCC(=O)NN)(C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCC(=O)NN)(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[P+](CCC(=O)NN)(C2=CC=CC=C2)C3=CC=CC=C3.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C21H21N2OP.H2O4S/c2*22-23-21(24)16-17-25(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;1-5(2,3)4/h2*1-15H,16-17,22H2;(H2,1,2,3,4)