2-[2-[2-(1-naphthalen-1-ylethyl)-4,5-dihydroimidazol-1-yl]ethylamino]ethylsulfanylphosphonic acid

Systemtic Name: 2-[2-[2-(1-naphthalen-1-ylethyl)-4,5-dihydroimidazol-1-yl]ethylamino]ethylsulfanylphosphonic acid Openeye Name: 2-[2-[2-[1-(1-naphthyl)ethyl]-4,5-dihydroimidazol-1-yl]ethylamino]ethylsulfanylphosphonic acid CAS Name: [2-[2-[2-[1-(1-naphthalenyl)ethyl]-4,5-dihydroimidazol-1-yl]ethylamino]ethylthio]phosphonic acid IUPAC Name: 2-[2-[2-(1-naphthalen-1-ylethyl)-4,5-dihydroimidazol-1-yl]ethylamino]ethylsulfanylphosphonic acid Traditional Name: [2-[2-[2-[1-(1-naphthyl)ethyl]-2-imidazolin-1-yl]ethylamino]ethylthio]phosphonic acid Formula: C19H26N3O3PS MolecularWeight: 407.466801

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C3=NCCN3CCNCCSP(=O)(O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C3=NCCN3CCNCCSP(=O)(O)O

InChI

InChI=1S/C19H26N3O3PS/c1-15(17-8-4-6-16-5-2-3-7-18(16)17)19-21-10-13-22(19)12-9-20-11-14-27-26(23,24)25/h2-8,15,20H,9-14H2,1H3,(H2,23,24,25)