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

Systemtic Name: 2-diethoxyphosphoryl-3-(5-nitroindol-1-yl)propanoic acid Openeye Name: 2-diethoxyphosphoryl-3-(5-nitroindol-1-yl)propanoic acid CAS Name: 2-diethoxyphosphoryl-3-(5-nitro-1-indolyl)propanoic acid IUPAC Name: 2-diethoxyphosphoryl-3-(5-nitroindol-1-yl)propanoic acid Traditional Name: 2-diethoxyphosphoryl-3-(5-nitroindol-1-yl)propionic acid Formula: C15H19N2O7P MolecularWeight: 370.294321

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CN1C=CC2=C1C=CC(=C2)[N+](=O)[O-])C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CN1C=CC2=C1C=CC(=C2)[N+](=O)[O-])C(=O)O)OCC

InChI

InChI=1S/C15H19N2O7P/c1-3-23-25(22,24-4-2)14(15(18)19)10-16-8-7-11-9-12(17(20)21)5-6-13(11)16/h5-9,14H,3-4,10H2,1-2H3,(H,18,19)