2-[4-[(5-ethoxy-3-methyl-1-benzofuran-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[4-[(5-ethoxy-3-methyl-1-benzofuran-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[4-(5-ethoxy-3-methyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[4-[(5-ethoxy-3-methyl-2-benzofuranyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[4-(5-ethoxy-3-methyl-1-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[4-(5-ethoxy-3-methyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(2-ethylphenyl)acetamide Formula: C26H32N3O4+ MolecularWeight: 450.54998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C=CC(=C4)OCC)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C4=C(O3)C=CC(=C4)OCC)C

InChI

InChI=1S/C26H31N3O4/c1-4-19-8-6-7-9-22(19)27-24(30)17-28-12-14-29(15-13-28)26(31)25-18(3)21-16-20(32-5-2)10-11-23(21)33-25/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,27,30)/p+1