1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propylpiperidin-1-ium-4-yl)urea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propylpiperidin-1-ium-4-yl)urea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propylpiperidin-1-ium-4-yl)urea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-propylpiperidin-1-ium-4-yl)urea Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H25N3O3/c1-2-7-20-8-5-13(6-9-20)18-17(21)19-14-3-4-15-16(12-14)23-11-10-22-15/h3-4,12-13H,2,5-11H2,1H3,(H2,18,19,21)/p+1