N-cyclopropyl-2-[4-[[3-(methoxymethyl)-1-benzofuran-2-yl]carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[[3-(methoxymethyl)-1-benzofuran-2-yl]carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[3-(methoxymethyl)benzofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[3-(methoxymethyl)-2-benzofuranyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[3-(methoxymethyl)-1-benzofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[3-(methoxymethyl)benzofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(OC2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

COCC1=C(OC2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C20H25N3O4/c1-26-13-16-15-4-2-3-5-17(15)27-19(16)20(25)23-10-8-22(9-11-23)12-18(24)21-14-6-7-14/h2-5,14H,6-13H2,1H3,(H,21,24)/p+1