2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]ethylazanium

Systemtic Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenoxy]ethylazanium Openeye Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]ethylammonium CAS Name: 2-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenoxy]ethylammonium IUPAC Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]ethylazanium Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenoxy]ethylammonium Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)OCC[NH3+]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)OCC[NH3+]

InChI

InChI=1S/C18H20N2O2/c19-9-11-22-17-7-3-6-15(12-17)18(21)20-10-8-14-4-1-2-5-16(14)13-20/h1-7,12H,8-11,13,19H2/p+1