N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]pentan-1-amine

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]pentan-1-amine Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]pentan-1-amine CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-1-pentanamine IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]pentan-1-amine Traditional Name: amyl-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]amine Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1COC2=CC=CC=C2O1

Isomeric SMILES

CCCCCNC[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C14H21NO2/c1-2-3-6-9-15-10-12-11-16-13-7-4-5-8-14(13)17-12/h4-5,7-8,12,15H,2-3,6,9-11H2,1H3/t12-/m0/s1