disodium ethyl 3-(3-phenylphenyl)-2-phosphonato-propanoate

Systemtic Name: disodium ethyl 3-(3-phenylphenyl)-2-phosphonato-propanoate Openeye Name: disodium ethyl 3-(3-phenylphenyl)-2-phosphonato-propanoate CAS Name: disodium 3-(3-phenylphenyl)-2-phosphonatopropanoic acid ethyl ester IUPAC Name: disodium ethyl 3-(3-phenylphenyl)-2-phosphonatopropanoate Traditional Name: disodium 3-(3-phenylphenyl)-2-phosphonato-propionic acid ethyl ester Formula: C17H17Na2O5P MolecularWeight: 378.267181

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC(=C1)C2=CC=CC=C2)P(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC(=C1)C2=CC=CC=C2)P(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C17H19O5P.2Na/c1-2-22-17(18)16(23(19,20)21)12-13-7-6-10-15(11-13)14-8-4-3-5-9-14;;/h3-11,16H,2,12H2,1H3,(H2,19,20,21);;/q;2*+1/p-2