[3-(methoxymethyl)-1-benzofuran-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [3-(methoxymethyl)-1-benzofuran-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [3-(methoxymethyl)benzofuran-2-yl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(methoxymethyl)-2-benzofuranyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [3-(methoxymethyl)-1-benzofuran-2-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [3-(methoxymethyl)benzofuran-2-yl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C20H23N2O3S+ MolecularWeight: 371.47322

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(OC2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

COCC1=C(OC2=CC=CC=C21)C(=O)N3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C20H22N2O3S/c1-24-14-17-16-6-2-3-7-18(16)25-19(17)20(23)22-10-8-21(9-11-22)13-15-5-4-12-26-15/h2-7,12H,8-11,13-14H2,1H3/p+1