2-(azocan-1-yl)-1-(1,3-benzodioxol-5-yl)ethanone

Systemtic Name: 2-(azocan-1-yl)-1-(1,3-benzodioxol-5-yl)ethanone Openeye Name: 2-(azocan-1-yl)-1-(1,3-benzodioxol-5-yl)ethanone CAS Name: 2-(1-azocanyl)-1-(1,3-benzodioxol-5-yl)ethanone IUPAC Name: 2-(azocan-1-yl)-1-(1,3-benzodioxol-5-yl)ethanone Traditional Name: 2-(azocan-1-yl)-1-(1,3-benzodioxol-5-yl)ethanone Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCN(CCC1)CC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H21NO3/c18-14(11-17-8-4-2-1-3-5-9-17)13-6-7-15-16(10-13)20-12-19-15/h6-7,10H,1-5,8-9,11-12H2