N-(1,3-benzodioxol-5-yl)-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-[[(3,5-dimethylanilino)-oxomethyl]amino]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H28N4O4/c1-15-9-16(2)11-19(10-15)26-23(29)25-17-5-7-27(8-6-17)13-22(28)24-18-3-4-20-21(12-18)31-14-30-20/h3-4,9-12,17H,5-8,13-14H2,1-2H3,(H,24,28)(H2,25,26,29)/p+1