N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C14H18N3O4+ MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H17N3O4/c18-13-8-17(4-3-15-13)9-14(19)16-10-1-2-11-12(7-10)21-6-5-20-11/h1-2,7H,3-6,8-9H2,(H,15,18)(H,16,19)/p+1