(2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide CAS Name: (2R)-2-(4-acetyl-1-piperazin-1-iumyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide IUPAC Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Traditional Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide Formula: C17H24N3O4+ MolecularWeight: 334.39016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)OCCO2)[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C17H23N3O4/c1-12(19-5-7-20(8-6-19)13(2)21)17(22)18-14-3-4-15-16(11-14)24-10-9-23-15/h3-4,11-12H,5-10H2,1-2H3,(H,18,22)/p+1/t12-/m1/s1