3-tert-butyl-3-[1-(1H-indol-3-yl)ethyl-oxidanyl-phosphoryl]-2-phenyl-hexanoic acid

Systemtic Name: 3-tert-butyl-3-[1-(1H-indol-3-yl)ethyl-oxidanyl-phosphoryl]-2-phenyl-hexanoic acid Openeye Name: 3-tert-butyl-3-[hydroxy-[1-(1H-indol-3-yl)ethyl]phosphoryl]-2-phenyl-hexanoic acid CAS Name: 3-tert-butyl-3-[hydroxy-[1-(1H-indol-3-yl)ethyl]phosphoryl]-2-phenylhexanoic acid IUPAC Name: 3-tert-butyl-3-[hydroxy-[1-(1H-indol-3-yl)ethyl]phosphoryl]-2-phenylhexanoic acid Traditional Name: 3-tert-butyl-3-[hydroxy-[1-(1H-indol-3-yl)ethyl]phosphoryl]-2-phenyl-hexanoic acid Formula: C26H34NO4P MolecularWeight: 455.526221

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C1=CC=CC=C1)C(=O)O)(C(C)(C)C)P(=O)(C(C)C2=CNC3=CC=CC=C32)O

Isomeric SMILES

CCCC(C(C1=CC=CC=C1)C(=O)O)(C(C)(C)C)P(=O)(C(C)C2=CNC3=CC=CC=C32)O

InChI

InChI=1S/C26H34NO4P/c1-6-16-26(25(3,4)5,23(24(28)29)19-12-8-7-9-13-19)32(30,31)18(2)21-17-27-22-15-11-10-14-20(21)22/h7-15,17-18,23,27H,6,16H2,1-5H3,(H,28,29)(H,30,31)