N-cyclopropyl-2-[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C19H26N3O5+ MolecularWeight: 376.42684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)N3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C19H25N3O5/c1-25-15-10-13(11-16-18(15)27-9-8-26-16)19(24)22-6-4-21(5-7-22)12-17(23)20-14-2-3-14/h10-11,14H,2-9,12H2,1H3,(H,20,23)/p+1