bis(oxidanidyl)-oxidanylidene-[1-phosphonato-2-(3-tridec-1-ynylphenyl)ethenyl]-$l^{5}-phosphane

Systemtic Name: bis(oxidanidyl)-oxidanylidene-[1-phosphonato-2-(3-tridec-1-ynylphenyl)ethenyl]-$l^{5}-phosphane Openeye Name: dioxido-oxo-[1-phosphonato-2-(3-tridec-1-ynylphenyl)vinyl]-$l^{5}-phosphane CAS Name: dioxido-oxo-[1-phosphonato-2-(3-tridec-1-ynylphenyl)ethenyl]phosphorane IUPAC Name: dioxido-oxo-[1-phosphonato-2-(3-tridec-1-ynylphenyl)ethenyl]-$l^{5}-phosphane Traditional Name: keto-dioxido-[1-phosphonato-2-(3-tridec-1-ynylphenyl)vinyl]phosphorane Formula: C21H28O6P2-4 MolecularWeight: 438.390942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CC1=CC(=CC=C1)C=C(P(=O)([O-])[O-])P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCCCC#CC1=CC(=CC=C1)C=C(P(=O)([O-])[O-])P(=O)([O-])[O-]

InChI

InChI=1S/C21H32O6P2/c1-2-3-4-5-6-7-8-9-10-11-12-14-19-15-13-16-20(17-19)18-21(28(22,23)24)29(25,26)27/h13,15-18H,2-11H2,1H3,(H2,22,23,24)(H2,25,26,27)/p-4