2-[4-[(2-butyl-1-benzofuran-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)ethanamide

Systemtic Name: 2-[4-[(2-butyl-1-benzofuran-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[4-[(2-butylbenzofuran-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide CAS Name: 2-[4-[(2-butyl-3-benzofuranyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[4-[(2-butyl-1-benzofuran-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide Traditional Name: 2-[4-[(2-butylbenzofuran-3-yl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide Formula: C23H37N3O3+2 MolecularWeight: 403.55818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C[NH+]3CC[NH+](CC3)CC(=O)NCCCOC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C[NH+]3CC[NH+](CC3)CC(=O)NCCCOC

InChI

InChI=1S/C23H35N3O3/c1-3-4-9-22-20(19-8-5-6-10-21(19)29-22)17-25-12-14-26(15-13-25)18-23(27)24-11-7-16-28-2/h5-6,8,10H,3-4,7,9,11-18H2,1-2H3,(H,24,27)/p+2