2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethanol

Systemtic Name: 2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethanol Openeye Name: 2-[[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ethanol CAS Name: 2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethanol IUPAC Name: 2-[4-(1,3-benzodioxol-5-yl)butan-2-ylamino]ethanol Traditional Name: 2-[[3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]amino]ethanol Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)NCCO

Isomeric SMILES

CC(CCC1=CC2=C(C=C1)OCO2)NCCO

InChI

InChI=1S/C13H19NO3/c1-10(14-6-7-15)2-3-11-4-5-12-13(8-11)17-9-16-12/h4-5,8,10,14-15H,2-3,6-7,9H2,1H3