2-(azocan-1-ium-1-yl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]acetamide Formula: C22H35N2O3+ MolecularWeight: 375.5249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NC(=O)C[NH+]3CCCCCCC3

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCCO2)NC(=O)C[NH+]3CCCCCCC3

InChI

InChI=1S/C22H34N2O3/c1-17(2)22(18-9-10-19-20(15-18)27-14-8-13-26-19)23-21(25)16-24-11-6-4-3-5-7-12-24/h9-10,15,17,22H,3-8,11-14,16H2,1-2H3,(H,23,25)/p+1/t22-/m1/s1