[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-hexyl-azanium

Systemtic Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-hexyl-azanium Openeye Name: hexyl-[[(1S)-isochroman-1-yl]methyl]ammonium CAS Name: [(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl-hexylammonium IUPAC Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-hexylazanium Traditional Name: hexyl-[[(1S)-isochroman-1-yl]methyl]ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH2+]CC1C2=CC=CC=C2CCO1

Isomeric SMILES

CCCCCC[NH2+]C[C@@H]1C2=CC=CC=C2CCO1

InChI

InChI=1S/C16H25NO/c1-2-3-4-7-11-17-13-16-15-9-6-5-8-14(15)10-12-18-16/h5-6,8-9,16-17H,2-4,7,10-13H2,1H3/p+1/t16-/m1/s1