N-(1-benzofuran-2-ylmethyl)-N',N'-diethyl-N-methyl-heptane-1,7-diamine; iodanylethane

Systemtic Name: N-(1-benzofuran-2-ylmethyl)-N',N'-diethyl-N-methyl-heptane-1,7-diamine; iodanylethane Openeye Name: N-(benzofuran-2-ylmethyl)-N',N'-diethyl-N-methyl-heptane-1,7-diamine; iodoethane CAS Name: N-(2-benzofuranylmethyl)-N',N'-diethyl-N-methylheptane-1,7-diamine; iodoethane IUPAC Name: N-(1-benzofuran-2-ylmethyl)-N',N'-diethyl-N-methylheptane-1,7-diamine; iodoethane Traditional Name: benzofuran-2-ylmethyl-[7-(diethylamino)heptyl]-methyl-amine; iodoethane Formula: C25H44I2N2O MolecularWeight: 642.4386

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCCCN(C)CC1=CC2=CC=CC=C2O1.CCI.CCI

Isomeric SMILES

CCN(CC)CCCCCCCN(C)CC1=CC2=CC=CC=C2O1.CCI.CCI

InChI

InChI=1S/C21H34N2O.2C2H5I/c1-4-23(5-2)16-12-8-6-7-11-15-22(3)18-20-17-19-13-9-10-14-21(19)24-20;2*1-2-3/h9-10,13-14,17H,4-8,11-12,15-16,18H2,1-3H3;2*2H2,1H3