2-(1H-indol-3-yl)hexan-3-yl-(phenylmethyl)phosphinic acid

Systemtic Name: 2-(1H-indol-3-yl)hexan-3-yl-(phenylmethyl)phosphinic acid Openeye Name: benzyl-[1-[1-(1H-indol-3-yl)ethyl]butyl]phosphinic acid CAS Name: 2-(1H-indol-3-yl)hexan-3-yl-(phenylmethyl)phosphinic acid IUPAC Name: benzyl-[2-(1H-indol-3-yl)hexan-3-yl]phosphinic acid Traditional Name: benzyl-[1-[1-(1H-indol-3-yl)ethyl]butyl]phosphinic acid Formula: C21H26NO2P MolecularWeight: 355.410401

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)C1=CNC2=CC=CC=C21)P(=O)(CC3=CC=CC=C3)O

Isomeric SMILES

CCCC(C(C)C1=CNC2=CC=CC=C21)P(=O)(CC3=CC=CC=C3)O

InChI

InChI=1S/C21H26NO2P/c1-3-9-21(25(23,24)15-17-10-5-4-6-11-17)16(2)19-14-22-20-13-8-7-12-18(19)20/h4-8,10-14,16,21-22H,3,9,15H2,1-2H3,(H,23,24)