(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

InChI

InChI=1S/C20H23N3O4/c1-25-17-12-16(13-18-19(17)27-11-10-26-18)20(24)23-8-6-22(7-9-23)14-15-2-4-21-5-3-15/h2-5,12-13H,6-11,14H2,1H3/p+1