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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Traditional Name: 2-(4-benzylpiperidin-1-ium-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H27N3O4/c27-22(16-26-10-8-18(9-11-26)14-17-4-2-1-3-5-17)25-23(28)24-19-6-7-20-21(15-19)30-13-12-29-20/h1-7,15,18H,8-14,16H2,(H2,24,25,27,28)/p+1