N-ethyl-N-methyl-ethanamine; 4-(4-methoxy-1-benzofuran-2-yl)-1-methyl-piperidine; hydrate; dihydrobromide

Systemtic Name: N-ethyl-N-methyl-ethanamine; 4-(4-methoxy-1-benzofuran-2-yl)-1-methyl-piperidine; hydrate; dihydrobromide Openeye Name: N-ethyl-N-methyl-ethanamine; 4-(4-methoxybenzofuran-2-yl)-1-methyl-piperidine; hydrate; dihydrobromide CAS Name: N-ethyl-N-methylethanamine; 4-(4-methoxy-2-benzofuranyl)-1-methylpiperidine; hydrate; dihydrobromide IUPAC Name: N-ethyl-N-methylethanamine; 4-(4-methoxy-1-benzofuran-2-yl)-1-methylpiperidine; hydrate; dihydrobromide Traditional Name: diethyl(methyl)amine; 4-(4-methoxybenzofuran-2-yl)-1-methyl-piperidine; hydrate; dihydrobromide Formula: C20H36Br2N2O3 MolecularWeight: 512.31944

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)CC.CN1CCC(CC1)C2=CC3=C(O2)C=CC=C3OC.O.Br.Br

Isomeric SMILES

CCN(C)CC.CN1CCC(CC1)C2=CC3=C(O2)C=CC=C3OC.O.Br.Br

InChI

InChI=1S/C15H19NO2.C5H13N.2BrH.H2O/c1-16-8-6-11(7-9-16)15-10-12-13(17-2)4-3-5-14(12)18-15;1-4-6(3)5-2;;;/h3-5,10-11H,6-9H2,1-2H3;4-5H2,1-3H3;2*1H;1H2