N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-piperidin-1-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(4-piperidin-1-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(piperidine-1-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[4-[oxo(1-piperidinyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(piperidine-1-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(piperidine-1-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C21H30N5O5+ MolecularWeight: 432.4934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)N2CC[NH+](CC2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCN(CC1)C(=O)N2CC[NH+](CC2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H29N5O5/c27-19(23-20(28)22-16-4-5-17-18(14-16)31-13-12-30-17)15-24-8-10-26(11-9-24)21(29)25-6-2-1-3-7-25/h4-5,14H,1-3,6-13,15H2,(H2,22,23,27,28)/p+1