(5-ethoxy-3-methyl-1-benzofuran-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (5-ethoxy-3-methyl-1-benzofuran-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (5-ethoxy-3-methyl-benzofuran-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (5-ethoxy-3-methyl-2-benzofuranyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (5-ethoxy-3-methyl-1-benzofuran-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (5-ethoxy-3-methyl-benzofuran-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C18H25N2O3+ MolecularWeight: 317.4027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CCC[NH+](CC3)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CCC[NH+](CC3)C

InChI

InChI=1S/C18H24N2O3/c1-4-22-14-6-7-16-15(12-14)13(2)17(23-16)18(21)20-9-5-8-19(3)10-11-20/h6-7,12H,4-5,8-11H2,1-3H3/p+1