2-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy]-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethanone

Systemtic Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy]-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethanone Openeye Name: 2-[[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methoxy]-1-(4-piperidin-1-ium-1-yl-1-piperidyl)ethanone CAS Name: 2-[[5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]methoxy]-1-[4-(1-piperidin-1-iumyl)-1-piperidinyl]ethanone IUPAC Name: 2-[[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methoxy]-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)ethanone Traditional Name: 2-[[5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methoxy]-1-(4-piperidin-1-ium-1-ylpiperidino)ethanone Formula: C23H30N3O5+ MolecularWeight: 428.5014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CCN(CC2)C(=O)COCC3=NOC(=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC[NH+](CC1)C2CCN(CC2)C(=O)COCC3=NOC(=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H29N3O5/c27-23(26-10-6-19(7-11-26)25-8-2-1-3-9-25)15-28-14-18-13-21(31-24-18)17-4-5-20-22(12-17)30-16-29-20/h4-5,12-13,19H,1-3,6-11,14-16H2/p+1