2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CC2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3/c25-22(15-18-6-7-20-21(14-18)27-13-12-26-20)23-19-8-10-24(11-9-19)16-17-4-2-1-3-5-17/h1-7,14,19H,8-13,15-16H2,(H,23,25)/p+1