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

Systemtic Name: 2-[4-[(3-methyl-5-propyl-1-benzofuran-2-yl)carbonyl]piperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-(3-methyl-5-propyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(3-methyl-5-propyl-2-benzofuranyl)-oxomethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-(3-methyl-5-propyl-1-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(3-methyl-5-propyl-benzofuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CC[NH+](CC3)CC(=O)NC(C)C

Isomeric SMILES

CCCC1=CC2=C(C=C1)OC(=C2C)C(=O)N3CC[NH+](CC3)CC(=O)NC(C)C

InChI

InChI=1S/C22H31N3O3/c1-5-6-17-7-8-19-18(13-17)16(4)21(28-19)22(27)25-11-9-24(10-12-25)14-20(26)23-15(2)3/h7-8,13,15H,5-6,9-12,14H2,1-4H3,(H,23,26)/p+1