2-(azocan-1-ium-1-yl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]acetamide Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C[NH+]3CCCCCCC3

Isomeric SMILES

CC(C)[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)C[NH+]3CCCCCCC3

InChI

InChI=1S/C21H32N2O3/c1-16(2)21(17-8-9-18-19(14-17)26-13-12-25-18)22-20(24)15-23-10-6-4-3-5-7-11-23/h8-9,14,16,21H,3-7,10-13,15H2,1-2H3,(H,22,24)/p+1/t21-/m1/s1