3-(5-cyanoindol-1-yl)-2-diethoxyphosphoryl-propanoic acid

Systemtic Name: 3-(5-cyanoindol-1-yl)-2-diethoxyphosphoryl-propanoic acid Openeye Name: 3-(5-cyanoindol-1-yl)-2-diethoxyphosphoryl-propanoic acid CAS Name: 3-(5-cyano-1-indolyl)-2-diethoxyphosphorylpropanoic acid IUPAC Name: 3-(5-cyanoindol-1-yl)-2-diethoxyphosphorylpropanoic acid Traditional Name: 3-(5-cyanoindol-1-yl)-2-diethoxyphosphoryl-propionic acid Formula: C16H19N2O5P MolecularWeight: 350.306221

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CN1C=CC2=C1C=CC(=C2)C#N)C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CN1C=CC2=C1C=CC(=C2)C#N)C(=O)O)OCC

InChI

InChI=1S/C16H19N2O5P/c1-3-22-24(21,23-4-2)15(16(19)20)11-18-8-7-13-9-12(10-17)5-6-14(13)18/h5-9,15H,3-4,11H2,1-2H3,(H,19,20)