3,4-dihydro-2H-chromen-6-yl-methyl-(phenylmethyl)azanium chloride

Systemtic Name: 3,4-dihydro-2H-chromen-6-yl-methyl-(phenylmethyl)azanium chloride Openeye Name: benzyl-chroman-6-yl-methyl-ammonium chloride CAS Name: 3,4-dihydro-2H-1-benzopyran-6-yl-methyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-(3,4-dihydro-2H-chromen-6-yl)-methylazanium chloride Traditional Name: benzyl-chroman-6-yl-methyl-ammonium chloride Formula: C17H20ClNO MolecularWeight: 289.7998

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2=CC3=C(C=C2)OCCC3.[Cl-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2=CC3=C(C=C2)OCCC3.[Cl-]

InChI

InChI=1S/C17H19NO.ClH/c1-18(13-14-6-3-2-4-7-14)16-9-10-17-15(12-16)8-5-11-19-17;/h2-4,6-7,9-10,12H,5,8,11,13H2,1H3;1H