2-(azocan-1-ium-1-yl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]acetamide Formula: C18H27N2O3+ MolecularWeight: 319.41858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C[NH+]3CCCCCCC3

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCO2)NC(=O)C[NH+]3CCCCCCC3

InChI

InChI=1S/C18H26N2O3/c1-14(15-7-8-16-17(11-15)23-13-22-16)19-18(21)12-20-9-5-3-2-4-6-10-20/h7-8,11,14H,2-6,9-10,12-13H2,1H3,(H,19,21)/p+1/t14-/m1/s1