3,4-dihydro-1H-isochromen-1-ylmethyl-(phenylmethyl)azanium chloride

Systemtic Name: 3,4-dihydro-1H-isochromen-1-ylmethyl-(phenylmethyl)azanium chloride Openeye Name: benzyl(isochroman-1-ylmethyl)ammonium chloride CAS Name: 3,4-dihydro-1H-2-benzopyran-1-ylmethyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl(3,4-dihydro-1H-isochromen-1-ylmethyl)azanium chloride Traditional Name: benzyl(isochroman-1-ylmethyl)ammonium chloride Formula: C17H20ClNO MolecularWeight: 289.7998

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=CC=CC=C21)C[NH2+]CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1COC(C2=CC=CC=C21)C[NH2+]CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C17H19NO.ClH/c1-2-6-14(7-3-1)12-18-13-17-16-9-5-4-8-15(16)10-11-19-17;/h1-9,17-18H,10-13H2;1H