(1R,2S)-2-[(dimethylazaniumyl)methyl-oxidanyl-phosphoryl]-2,3-dihydro-1H-indene-1-carboxylate

Systemtic Name: (1R,2S)-2-[(dimethylazaniumyl)methyl-oxidanyl-phosphoryl]-2,3-dihydro-1H-indene-1-carboxylate Openeye Name: (1R,2S)-2-[(dimethylammonio)methyl-hydroxy-phosphoryl]indane-1-carboxylate CAS Name: (1R,2S)-2-[(dimethylammonio)methyl-hydroxyphosphoryl]-2,3-dihydro-1H-indene-1-carboxylate IUPAC Name: (1R,2S)-2-[(dimethylazaniumyl)methyl-hydroxyphosphoryl]-2,3-dihydro-1H-indene-1-carboxylate Traditional Name: (1R,2S)-2-[(dimethylammonio)methyl-hydroxy-phosphoryl]indane-1-carboxylate Formula: C13H18NO4P MolecularWeight: 283.260081

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CP(=O)(C1CC2=CC=CC=C2C1C(=O)[O-])O

Isomeric SMILES

C[NH+](C)CP(=O)([C@H]1CC2=CC=CC=C2[C@@H]1C(=O)[O-])O

InChI

InChI=1S/C13H18NO4P/c1-14(2)8-19(17,18)11-7-9-5-3-4-6-10(9)12(11)13(15)16/h3-6,11-12H,7-8H2,1-2H3,(H,15,16)(H,17,18)/t11-,12-/m0/s1