1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone

Systemtic Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone Openeye Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone CAS Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone IUPAC Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone Traditional Name: 1-(1,4-diazepan-4-ium-1-yl)-2-(2-methoxyphenoxy)ethanone Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)N2CCC[NH2+]CC2

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)N2CCC[NH2+]CC2

InChI

InChI=1S/C14H20N2O3/c1-18-12-5-2-3-6-13(12)19-11-14(17)16-9-4-7-15-8-10-16/h2-3,5-6,15H,4,7-11H2,1H3/p+1