[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-(2-methylpropyl)azanium

Systemtic Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-(2-methylpropyl)azanium Openeye Name: isobutyl-[[(1S)-isochroman-1-yl]methyl]ammonium CAS Name: [(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl-(2-methylpropyl)ammonium IUPAC Name: [(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl-(2-methylpropyl)azanium Traditional Name: isobutyl-[[(1S)-isochroman-1-yl]methyl]ammonium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC1C2=CC=CC=C2CCO1

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO/c1-11(2)9-15-10-14-13-6-4-3-5-12(13)7-8-16-14/h3-6,11,14-15H,7-10H2,1-2H3/p+1/t14-/m1/s1