2-(azepan-1-yl)-1-(1,4-benzodioxin-3-yl)ethanol

Systemtic Name: 2-(azepan-1-yl)-1-(1,4-benzodioxin-3-yl)ethanol Openeye Name: 2-(azepan-1-yl)-1-(1,4-benzodioxin-3-yl)ethanol CAS Name: 2-(1-azepanyl)-1-(1,4-benzodioxin-3-yl)ethanol IUPAC Name: 2-(azepan-1-yl)-1-(1,4-benzodioxin-3-yl)ethanol Traditional Name: 2-(azepan-1-yl)-1-(1,4-benzodioxin-3-yl)ethanol Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(C2=COC3=CC=CC=C3O2)O

Isomeric SMILES

C1CCCN(CC1)CC(C2=COC3=CC=CC=C3O2)O

InChI

InChI=1S/C16H21NO3/c18-13(11-17-9-5-1-2-6-10-17)16-12-19-14-7-3-4-8-15(14)20-16/h3-4,7-8,12-13,18H,1-2,5-6,9-11H2