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

Systemtic Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide CAS Name: N-[(1,3-benzodioxol-5-ylamino)-oxomethyl]-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide Traditional Name: N-(1,3-benzodioxol-5-ylcarbamoyl)-2-(4-benzylpiperidin-1-ium-1-yl)acetamide Formula: C22H26N3O4+ MolecularWeight: 396.45954

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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)OCO4

Isomeric SMILES

C1C[NH+](CCC1CC2=CC=CC=C2)CC(=O)NC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25N3O4/c26-21(24-22(27)23-18-6-7-19-20(13-18)29-15-28-19)14-25-10-8-17(9-11-25)12-16-4-2-1-3-5-16/h1-7,13,17H,8-12,14-15H2,(H2,23,24,26,27)/p+1