N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]acetamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]acetamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]acetamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]acetamide Formula: C19H26ClN4O4+ MolecularWeight: 409.88714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C19H25ClN4O4/c20-14-9-16-17(28-13-27-16)10-15(14)21-18(25)11-22-5-7-23(8-6-22)12-19(26)24-3-1-2-4-24/h9-10H,1-8,11-13H2,(H,21,25)/p+1