(3-ethyl-1-thiophen-3-yl-hexan-3-yl)-(phenylmethyl)phosphinic acid

Systemtic Name: (3-ethyl-1-thiophen-3-yl-hexan-3-yl)-(phenylmethyl)phosphinic acid Openeye Name: benzyl-[1-ethyl-1-[2-(3-thienyl)ethyl]butyl]phosphinic acid CAS Name: [3-ethyl-1-(3-thiophenyl)hexan-3-yl]-(phenylmethyl)phosphinic acid IUPAC Name: benzyl-(3-ethyl-1-thiophen-3-ylhexan-3-yl)phosphinic acid Traditional Name: benzyl-[1-ethyl-1-[2-(3-thienyl)ethyl]butyl]phosphinic acid Formula: C19H27O2PS MolecularWeight: 350.455241

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(CCC1=CSC=C1)P(=O)(CC2=CC=CC=C2)O

Isomeric SMILES

CCCC(CC)(CCC1=CSC=C1)P(=O)(CC2=CC=CC=C2)O

InChI

InChI=1S/C19H27O2PS/c1-3-12-19(4-2,13-10-18-11-14-23-16-18)22(20,21)15-17-8-6-5-7-9-17/h5-9,11,14,16H,3-4,10,12-13,15H2,1-2H3,(H,20,21)